olanzapine


SMILES CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C
InChIKey WXPNDRBBWZMPQG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 1
Molecular weight (Da) 312.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Ligand site mutations 5-HT1A 5-HT2C 5-HT7 D2 D4

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.6 5.7 5.8 Guide to Pharmacology
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 6.3 6.3 6.3 Guide to Pharmacology
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 6.2 6.2 6.2 Guide to Pharmacology
5-HT1E 5HT1E Human 5-Hydroxytryptamine A pKi 5.7 5.7 5.7 Guide to Pharmacology
5-HT1F 5HT1F Human 5-Hydroxytryptamine A pKi 6.5 6.5 6.5 Guide to Pharmacology
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.6 8.75 8.9 Guide to Pharmacology
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 8.1 8.25 8.4 Guide to Pharmacology
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 8.0 8.0 8.0 Guide to Pharmacology
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.5 6.5 6.5 Guide to Pharmacology
D2 DRD2 Human Dopamine A pKi 8.68 8.68 8.68 Guide to Pharmacology
H1 HRH1 Human Histamine A pKi 8.7 8.95 9.2 Guide to Pharmacology
5-HT6 5HT6R Rat 5-Hydroxytryptamine A pKi 7.6 8.1 8.6 Guide to Pharmacology
5-HT7 5HT7R Rat 5-Hydroxytryptamine A pKi 6.8 6.9 7.0 Guide to Pharmacology
H1 HRH1 Rat Histamine A pKi 8.37 8.95 9.52 ChEMBL
D4 DRD4 Rat Dopamine A pKi 7.3 7.3 7.3 ChEMBL
D3 DRD3 Rat Dopamine A pKi 7.12 7.34 7.41 ChEMBL
D5 DRD5 Human Dopamine A pKi 7.0 7.03 7.05 ChEMBL
D1 DRD1 Rat Dopamine A pKi 6.93 7.19 7.7 ChEMBL
H1 HRH1 Guinea pig Histamine A pKi 8.2 8.2 8.2 ChEMBL
5-HT1B 5HT1B Rat 5-Hydroxytryptamine A pKi 6.36 6.36 6.36 ChEMBL
α1B ADA1B Rat Adrenoceptors A pKi 7.16 7.42 7.68 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 6.0 6.0 6.0 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 6.0 6.0 6.0 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 7.58 7.59 7.6 ChEMBL
M1 ACM1 Rat Acetylcholine (muscarinic) A pKi 7.66 7.66 7.66 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.35 7.35 7.35 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 6.72 6.86 7.0 ChEMBL
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 7.54 7.77 8.0 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 7.0 7.07 7.11 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.0 6.59 7.1 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 6.0 7.19 7.9 ChEMBL
H1 HRH1 Human Histamine A pKi 8.0 8.47 8.92 ChEMBL
H1 HRH1 Human Histamine A pKd 10.06 10.06 10.06 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 7.0 7.04 7.08 ChEMBL
D2 DRD2 Rat Dopamine A pKi 7.02 7.44 8.15 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.0 7.49 7.72 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.0 6.81 7.22 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.21 6.21 6.21 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.0 6.47 6.72 ChEMBL
D1 DRD1 Human Dopamine A pKi 6.6 7.22 8.0 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 7.97 8.11 8.3 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 7.44 7.82 8.2 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 7.0 7.0 7.0 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 7.85 8.11 8.55 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 7.0 8.0 8.68 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.0 7.36 7.7 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.0 8.45 9.38 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.15 5.6 6.21 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKd 5.9 5.9 5.9 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.76 7.7 8.68 ChEMBL
5-HT6 5HT6R Rat 5-Hydroxytryptamine A pKi 7.56 8.39 8.6 PDSP Ki database
5-HT7 5HT7R Rat 5-Hydroxytryptamine A pKi 6.82 6.93 7.0 PDSP Ki database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.62 8.44 8.88 PDSP Ki database
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 7.15 7.88 8.39 PDSP Ki database
D1 DRD1 Human Dopamine A pKi 6.92 7.21 7.6 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 6.97 7.66 8.52 PDSP Ki database
D3 DRD3 Human Dopamine A pKi 7.04 7.5 8.11 PDSP Ki database
D4 DRD4 Human Dopamine A pKi 7.22 7.87 8.8 PDSP Ki database
D5 DRD5 Human Dopamine A pKi 7.05 7.09 7.13 PDSP Ki database
5-HT2A 5HT2A Rat 5-Hydroxytryptamine A pKi 7.88 8.46 8.8 PDSP Ki database
D1 DRD1 Rat Dopamine A pKi 6.6 7.23 8.0 PDSP Ki database
D2 DRD2 Rat Dopamine A pKi 7.16 7.69 8.68 PDSP Ki database
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 7.38 8.04 8.3 PDSP Ki database
D4 DRD4 Rat Dopamine A pKi 7.82 7.92 8.02 PDSP Ki database
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 7.92 8.0 8.14 PDSP Ki database
5-HT2B 5HT2B Rat 5-Hydroxytryptamine A pKi 7.27 7.27 7.27 PDSP Ki database
D2 A0A287B0Q7 Pig Dopamine A pKi 8.12 8.12 8.12 PDSP Ki database
5-HT7 5HT7R Mouse 5-Hydroxytryptamine A pKi 6.92 6.92 6.92 PDSP Ki database
5-HT1B 5HT1B Rat 5-Hydroxytryptamine A pKi 5.55 5.71 5.87 PDSP Ki database
5-HT2C K7GSR7 Pig 5-Hydroxytryptamine A pKi 8.15 8.36 8.57 PDSP Ki database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.46 5.7 6.21 PDSP Ki database
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 5.5 5.99 6.29 PDSP Ki database
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 5.8 6.21 6.82 PDSP Ki database
D3 DRD3 Rat Dopamine A pKi 7.2 7.54 8.7 PDSP Ki database
H1 HRH1 Guinea pig Histamine A pKi 8.46 8.46 8.46 PDSP Ki database
5-HT1E 5HT1E Human 5-Hydroxytryptamine A pKi 5.62 5.66 5.7 PDSP Ki database
5-HT1F 5HT1F Human 5-Hydroxytryptamine A pKi 6.51 6.51 6.51 PDSP Ki database
α2A ADA2A Human Adrenoceptors A pKi 6.33 6.51 6.72 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 6.74 6.97 7.09 PDSP Ki database
α2C ADA2C Human Adrenoceptors A pKi 6.68 7.21 7.54 PDSP Ki database
β1 ADRB1 Human Adrenoceptors A pKi 5.0 5.15 5.3 PDSP Ki database
β2 ADRB2 Human Adrenoceptors A pKi 5.0 5.08 5.3 PDSP Ki database
H1 HRH1 Human Histamine A pKi 8.15 8.85 10.06 PDSP Ki database
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 5.15 5.82 6.21 PDSP Ki database
5-HT2C 5HT2C Rat 5-Hydroxytryptamine A pKi 7.62 8.05 8.55 PDSP Ki database
H1 HRH1 Rat Histamine A pKi 7.59 8.33 9.46 PDSP Ki database
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 5.86 5.89 5.92 PDSP Ki database
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.44 6.7 6.98 PDSP Ki database
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 7.14 8.03 8.7 PDSP Ki database
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 6.21 7.0 7.32 PDSP Ki database
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.88 7.33 7.89 PDSP Ki database
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 6.0 7.35 8.0 PDSP Ki database
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 7.09 7.78 8.22 PDSP Ki database
α1B ADA1B Human Adrenoceptors A pKi 6.58 6.58 6.58 PDSP Ki database
α1D ADA1D Human Adrenoceptors A pKi 6.94 7.04 7.22 PDSP Ki database
H2 HRH2 Human Histamine A pKi 7.36 7.36 7.36 PDSP Ki database
H4 HRH4 Human Histamine A pKi 5.0 5.0 5.0 PDSP Ki database
EP3 PE2R3 Human Prostanoid A pKi 5.0 5.0 5.0 PDSP Ki database
EP4 PE2R4 Human Prostanoid A pKi 5.0 5.0 5.0 PDSP Ki database
H3 HRH3 Guinea pig Histamine A pKi 5.43 5.43 5.43 PDSP Ki database
M4 ACM4 Rat Acetylcholine (muscarinic) A pKi 7.89 7.89 7.89 PDSP Ki database
M2 ACM2 Rat Acetylcholine (muscarinic) A pKi 7.74 7.74 7.74 PDSP Ki database
M1 ACM1 Rat Acetylcholine (muscarinic) A pKi 7.66 8.19 8.72 PDSP Ki database
M3 ACM3 Rat Acetylcholine (muscarinic) A pKi 7.36 7.52 7.6 PDSP Ki database
5-HT1D F1MMU1 Bovine 5-Hydroxytryptamine A pKi 6.1 6.1 6.1 PDSP Ki database
TP TA2R Human Prostanoid A pKi 6.0 6.0 6.0 PDSP Ki database
δ OPRD Mouse Opioid A pKi 6.0 6.0 6.0 PDSP Ki database
μ OPRM Rat Opioid A pKi 6.0 6.0 6.0 PDSP Ki database
CCK2 GASR Rat Cholecystokinin A pKi 6.0 6.0 6.0 PDSP Ki database
κ OPRK Guinea pig Opioid A pKi 6.0 6.0 6.0 PDSP Ki database
PAF PTAFR Human Platelet-activating factor A pKi 6.0 6.0 6.0 PDSP Ki database
D3 A0A4W2FUW7 Hybrid cattle Dopamine A pKi 7.41 7.41 7.41 PDSP Ki database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKd 8.23 8.23 8.23 Drug Central
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 8.21 8.21 8.21 Drug Central
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 8.21 8.21 8.21 Drug Central
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.08 8.08 8.08 Drug Central
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 8.1 8.1 8.1 Drug Central
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 8.1 8.1 8.1 Drug Central
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 8.23 8.23 8.23 Drug Central
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 8.09 8.09 8.09 Drug Central
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 8.16 8.16 8.16 Drug Central
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 8.12 8.12 8.12 Drug Central
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 8.15 8.15 8.15 Drug Central
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 8.15 8.15 8.15 Drug Central
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 8.11 8.11 8.11 Drug Central
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 8.09 8.09 8.09 Drug Central
α1A ADA1A Human Adrenoceptors A pKi 8.11 8.11 8.11 Drug Central
α1B ADA1B Human Adrenoceptors A pKi 8.18 8.18 8.18 Drug Central
α1D ADA1D Human Adrenoceptors A pKi 8.12 8.12 8.12 Drug Central
α2A ADA2A Human Adrenoceptors A pKi 8.19 8.19 8.19 Drug Central
α2B ADA2B Human Adrenoceptors A pKi 8.15 8.15 8.15 Drug Central
α2C ADA2C Human Adrenoceptors A pKi 8.12 8.12 8.12 Drug Central
β1 ADRB1 Human Adrenoceptors A pKi 8.28 8.28 8.28 Drug Central
β2 ADRB2 Human Adrenoceptors A pKi 8.28 8.28 8.28 Drug Central
D1 DRD1 Human Dopamine A pKi 8.13 8.13 8.13 Drug Central
D2 DRD2 Human Dopamine A pKi 8.07 8.07 8.07 Drug Central
D3 DRD3 Human Dopamine A pKi 8.09 8.09 8.09 Drug Central
D4 DRD4 Human Dopamine A pKi 8.06 8.06 8.06 Drug Central
D5 DRD5 Human Dopamine A pKi 8.15 8.15 8.15 Drug Central
H1 HRH1 Human Histamine A pKi 8.09 8.09 8.09 Drug Central
H2 HRH2 Human Histamine A pKi 8.13 8.13 8.13 Drug Central
5-HT1F 5HT1F Human 5-Hydroxytryptamine A pKi 8.19 8.19 8.19 Drug Central
5-HT6 5HT6R Rat 5-Hydroxytryptamine A pKi 8.07 8.07 8.07 Drug Central
D3 DRD3 Rat Dopamine A pKi 8.13 8.13 8.13 Drug Central
α1B ADA1B Rat Adrenoceptors A pKi 8.11 8.11 8.11 Drug Central
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 8.21 8.21 8.21 Drug Central
H1 HRH1 Guinea pig Histamine A pKi 8.09 8.09 8.09 Drug Central
H1 HRH1 Rat Histamine A pKi 8.02 8.02 8.02 Drug Central
5-HT1B 5HT1B Rat 5-Hydroxytryptamine A pKi 8.2 8.2 8.2 Drug Central
5-HT7 5HT7R Rat 5-Hydroxytryptamine A pKi 8.15 8.15 8.15 Drug Central
D4 DRD4 Rat Dopamine A pKi 8.14 8.14 8.14 Drug Central
D2 DRD2 Rat Dopamine A pKi 8.1 8.1 8.1 Drug Central
M1 ACM1 Rat Acetylcholine (muscarinic) A pKi 8.12 8.12 8.12 Drug Central
5-HT1E 5HT1E Human 5-Hydroxytryptamine A pKi 8.24 8.24 8.24 Drug Central
5-HT2A 5HT2A Rat 5-Hydroxytryptamine A pKi 8.08 8.08 8.08 Drug Central
D1 DRD1 Rat Dopamine A pKi 8.11 8.11 8.11 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1A ADA1A Rat Adrenoceptors A pA2 7.4 7.4 7.4 Guide to Pharmacology
α1D G3V8W0 Rat Adrenoceptors A pA2 6.4 6.4 6.4 Guide to Pharmacology
H1 HRH1 Rat Histamine A pIC50 7.89 7.89 7.89 ChEMBL
5-HT1B 5HT1B Rat 5-Hydroxytryptamine A pIC50 6.15 6.15 6.15 ChEMBL
α1B ADA1B Rat Adrenoceptors A pIC50 7.43 7.43 7.43 ChEMBL
α1A ADA1A Rat Adrenoceptors A pIC50 7.19 7.19 7.19 ChEMBL
α1D ADA1D Human Adrenoceptors A pIC50 7.04 7.04 7.04 ChEMBL
α2B ADA2B Human Adrenoceptors A pIC50 6.38 6.38 6.38 ChEMBL
M5 ACM5 Human Acetylcholine (muscarinic) A pIC50 7.4 7.4 7.4 ChEMBL
α2C ADA2C Human Adrenoceptors A pIC50 6.28 6.28 6.28 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pIC50 6.81 6.81 6.81 ChEMBL
H1 HRH1 Human Histamine A pIC50 7.89 7.89 7.89 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pIC50 6.41 6.41 6.41 ChEMBL
D2 DRD2 Rat Dopamine A pIC50 6.8 6.8 6.8 ChEMBL
D4 DRD4 Human Dopamine A pIC50 6.76 6.76 6.76 ChEMBL
α2A ADA2A Human Adrenoceptors A pIC50 6.27 6.27 6.27 ChEMBL
D1 DRD1 Human Dopamine A pIC50 7.14 7.14 7.14 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pIC50 7.89 7.89 7.89 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pIC50 7.24 7.24 7.24 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pIC50 7.15 7.42 7.68 ChEMBL
D3 DRD3 Human Dopamine A pIC50 7.11 7.11 7.11 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pIC50 7.0 7.88 8.3 ChEMBL
D2 DRD2 Human Dopamine A pIC50 6.93 7.46 8.0 ChEMBL
α1A ADA1A Rat Adrenoceptors A pIC50 8.14 8.14 8.14 Drug Central