Biased Signaling Atlas

cinacalcet

Agent/drug
Bioactivity

cinacalcet

SMILES	C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
InChIKey	VDHAWDNDOKGFTD-MRXNPFEDSA-N

Chemical Properties

Hydrogen bond acceptors	1
Hydrogen bond donors	1
Rotatable bonds	6
Molecular weight (Da)	357.2

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central PubChem GPCRdb
Structure pdb	8SZH 8SZF 8SZG 7M3F 8WPG 8WPU
Ligand site mutations	CaS

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1B	ADA1B	Human	Adrenoceptors	A	pKi	5.54	5.54	5.54	ChEMBL
α_2C	ADA2C	Human	Adrenoceptors	A	pKi	5.80	5.80	5.80	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	6.35	6.35	6.35	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	5.89	5.89	5.89	ChEMBL
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	5.71	5.71	5.71	ChEMBL
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	5.77	5.77	5.77	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	6.08	6.08	6.08	ChEMBL
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	7.40	7.40	7.40	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	6.18	6.18	6.18	ChEMBL
5-HT_5A	5HT5A	Human	5-Hydroxytryptamine	A	pKi	6.01	6.01	6.01	ChEMBL
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pKi	5.74	5.74	5.74	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pKi	6.24	6.24	6.24	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	6.41	6.41	6.41	ChEMBL
H₂	HRH2	Human	Histamine	A	pKi	5.58	5.58	5.58	ChEMBL
mGlu₅	GRM5	Rat	Metabotropic glutamate	C	pKi	4.35	4.35	4.35	Guide to Pharmacology
mGlu₅	GRM5	Rat	Metabotropic glutamate	C	pKi	8.36	8.36	8.36	Drug Central

Showing 1 to 16 of 16 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

CaS	CASR	Human	Calcium-sensing	C	pKB	5.90	6.25	6.60	Guide to Pharmacology
CaS	CASR	Human	Calcium-sensing	C	pEC50	7.30	7.30	7.30	Guide to Pharmacology
CaS	CASR	Human	Calcium-sensing	C	pEC50	6.75	7.49	8.40	ChEMBL
CaS	CASR	Human	Calcium-sensing	C	pEC50	8.11	8.11	8.11	Drug Central
FPR1	FPR1	Human	Formylpeptide	A	pIC50	5.10	5.10	5.10	ChEMBL
FPR3	FPR3	Human	Formylpeptide	A	pIC50	5.40	5.40	5.40	ChEMBL
GPR183	GP183	Human	A orphans	A	pIC50	5.44	5.44	5.44	ChEMBL
GPR35	GPR35	Human	A orphans	A	pIC50	5.47	5.47	5.47	ChEMBL
GPR65	PSYR	Human	A orphans	A	pIC50	5.52	5.52	5.52	ChEMBL

Showing 1 to 9 of 9 entries

cinacalcet

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	Yes

Distribution across phases (no. indications)

Phase I 1

Phase II 1

Phase III 0

Phase IV 5

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central PubChem GPCRdb
Structure pdb	8SZH 8SZF 8SZG 7M3F 8WPG 8WPU
Ligand site mutations	CaS

Sankey plot

Drug Information

Search:

Target					Disease

Gene	Protein	Receptor family	Ligand type	Class	Name	Phase	ICD11	ATC	Association score

CASR	CaS receptor	Calcium-sensing receptors	Ion receptors	C	Adenocarcinoma of prostate	2	2C82.0	H05B	0.092
CASR	CaS receptor	Calcium-sensing receptors	Ion receptors	C	Chronic kidney disease, stage unspecified	4	GB61.Z	H05B	0.309
CASR	CaS receptor	Calcium-sensing receptors	Ion receptors	C	Hyperparathyroidism, unspecified	4	5A51.Z	H05B	0.591
CASR	CaS receptor	Calcium-sensing receptors	Ion receptors	C	Hypophosphataemic rickets	1	5C63.22	H05B	0.038
CASR	CaS receptor	Calcium-sensing receptors	Ion receptors	C	Other specified malignant neoplasms of other endocrine glands or related structures	4	2D12.Y	H05B	0.581
CASR	CaS receptor	Calcium-sensing receptors	Ion receptors	C	Primary hyperparathyroidism	4	5A51.0	H05B	0.117
CASR	CaS receptor	Calcium-sensing receptors	Ion receptors	C	Secondary hyperparathyroidism	4	5A51.1	H05B	0.601

Showing 1 to 7 of 7 entries