GPCRdb

SERTRALINE

Agent/drug
Bioactivity

SERTRALINE

SMILES	CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21
InChIKey	VGKDLMBJGBXTGI-SJCJKPOMSA-N

Chemical Properties

Hydrogen bond acceptors	1
Hydrogen bond donors	1
Rotatable bonds	2
Molecular weight (Da)	305.1

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1A	ADA1A	Human	Adrenoceptors	A	pKi	8.16	8.16	8.16	Drug Central
α_1B	ADA1B	Rat	Adrenoceptors	A	pKi	6.47	6.47	6.47	ChEMBL
α_1B	ADA1B	Rat	Adrenoceptors	A	pKi	8.19	8.19	8.19	Drug Central
α_1D	ADA1D	Human	Adrenoceptors	A	pKi	6.55	6.55	6.55	PDSP Ki database
α_2A	ADA2A	Human	Adrenoceptors	A	pKi	6.96	6.96	6.96	ChEMBL
α_2A	ADA2A	Human	Adrenoceptors	A	pKi	8.16	8.16	8.16	Drug Central
α_2B	ADA2B	Human	Adrenoceptors	A	pKi	7.08	7.08	7.08	ChEMBL
α_2B	ADA2B	Human	Adrenoceptors	A	pKi	8.15	8.15	8.15	Drug Central
α_2C	ADA2C	Human	Adrenoceptors	A	pKi	6.19	6.19	6.19	ChEMBL
α_2C	ADA2C	Human	Adrenoceptors	A	pKi	8.21	8.21	8.21	Drug Central
β₂	ADRB2	Rat	Adrenoceptors	A	pKi	5.00	5.00	5.00	PDSP Ki database
5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pKi	5.00	5.22	5.44	PDSP Ki database
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	5.00	5.00	5.00	PDSP Ki database
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	6.11	6.11	6.11	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	8.21	8.21	8.21	Drug Central
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	5.67	5.67	5.67	ChEMBL
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	8.25	8.25	8.25	Drug Central
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	6.25	6.25	6.25	ChEMBL
5-HT_2C	5HT2C	Rat	5-Hydroxytryptamine	A	pKi	6.00	6.00	6.00	PDSP Ki database
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	5.64	5.82	6.00	PDSP Ki database

Showing 1 to 20 of 43 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1B	ADA1B	Rat	Adrenoceptors	A	pIC50	6.22	6.22	6.22	ChEMBL
α_2A	ADA2A	Human	Adrenoceptors	A	pIC50	6.54	6.54	6.54	ChEMBL
α_2B	ADA2B	Human	Adrenoceptors	A	pIC50	6.74	6.74	6.74	ChEMBL
α_2C	ADA2C	Human	Adrenoceptors	A	pIC50	5.35	5.35	5.35	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pIC50	5.56	5.56	5.56	ChEMBL
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pIC50	5.47	5.47	5.47	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pIC50	5.96	5.96	5.96	ChEMBL
M₁	ACM1	Rat	Acetylcholine (muscarinic)	A	Potency	4.90	5.03	5.15	ChEMBL
M₁	ACM1	Human	Acetylcholine (muscarinic)	A	pIC50	5.89	5.89	5.89	ChEMBL
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pIC50	5.56	5.56	5.56	ChEMBL
M₄	ACM4	Human	Acetylcholine (muscarinic)	A	pIC50	5.58	5.58	5.58	ChEMBL
M₅	ACM5	Human	Acetylcholine (muscarinic)	A	pIC50	6.29	6.29	6.29	ChEMBL
MC₅	MC5R	Human	Melanocortin	A	pIC50	5.34	5.34	5.34	ChEMBL
TSH	TSHR	Human	Glycoprotein hormone	A	Potency	4.40	4.40	4.40	ChEMBL

Showing 1 to 14 of 14 entries

SERTRALINE

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Clinical Trials

Phase I 0

Phase II 0

Phase III 0

Approved No

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.