GPCRdb

methiothepin

SMILES	CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C
InChIKey	RLJFTICUTYVZDG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors	4
Hydrogen bond donors	0
Rotatable bonds	2
Molecular weight (Da)	356.1

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids PubChem GPCRdb
Ligand site mutations	5-HT_1B 5-HT_2A

Search:

Receptor					Activity				Source
GTP No matches found	Uniprot No matches found	Species No matches found	Family No matches found	Class No matches found	Type No matches found	Min	Avg	Max	Database No matches found
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	6.2	7.98	8.66	ChEMBL
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	6.09	7.44	8.4	PDSP Ki database
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	7.8	7.95	8.1	Guide to Pharmacology
5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pKi	5.94	7.14	8.06	PDSP Ki database
5-HT_1B	5HT1B	Human	5-Hydroxytryptamine	A	pKi	7.4	8.41	9.72	PDSP Ki database
5-HT_1B	5HT1B	Human	5-Hydroxytryptamine	A	pKi	7.1	7.8	8.5	Guide to Pharmacology
5-HT_1B	5HT1B	Rat	5-Hydroxytryptamine	A	pKi	7.0	7.4	7.98	PDSP Ki database
5-HT_1B	5HT1B	Guinea pig	5-Hydroxytryptamine	A	pKi	7.96	7.96	7.96	PDSP Ki database
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	6.77	7.85	8.24	PDSP Ki database
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	7.3	7.75	8.2	Guide to Pharmacology
5-HT_1D	5HT1D	Rat	5-Hydroxytryptamine	A	pKi	9.22	9.23	9.24	PDSP Ki database
5-HT_1D	F1MMU1	Bovine	5-Hydroxytryptamine	A	pKi	6.25	6.76	7.44	PDSP Ki database
5-HT_1E	5HT1E	Human	5-Hydroxytryptamine	A	pKi	6.68	6.75	6.92	PDSP Ki database
5-HT_1E	5HT1E	Human	5-Hydroxytryptamine	A	pKi	6.7	6.85	7.0	Guide to Pharmacology
5-HT_1F	5HT1F	Human	5-Hydroxytryptamine	A	pKi	6.19	6.19	6.19	PDSP Ki database
5-HT_1F	5HT1F	Human	5-Hydroxytryptamine	A	pKi	6.2	6.2	6.2	Guide to Pharmacology
5-HT_1F	5HT1F	Rat	5-Hydroxytryptamine	A	pKi	6.0	6.0	6.0	PDSP Ki database
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	8.5	9.12	10.0	PDSP Ki database
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	8.7	8.7	8.7	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	8.5	8.5	8.5	Guide to Pharmacology
5-HT_2A	5HT2A	Rat	5-Hydroxytryptamine	A	pKi	8.76	8.97	9.6	PDSP Ki database
5-HT_2A	5HT2A	Pig	5-Hydroxytryptamine	A	pKi	8.8	8.8	8.8	PDSP Ki database
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	8.68	8.91	9.24	PDSP Ki database
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	8.7	8.95	9.2	Guide to Pharmacology
5-HT_2C	K7GSR7	Pig	5-Hydroxytryptamine	A	pKi	7.56	7.74	8.5	PDSP Ki database
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	8.35	8.9	9.47	PDSP Ki database
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	8.4	8.4	8.4	Guide to Pharmacology
5-HT_2C	5HT2C	Rat	5-Hydroxytryptamine	A	pKi	8.61	8.68	8.76	PDSP Ki database
5-HT_5A	5HT5A	Human	5-Hydroxytryptamine	A	pKi	7.0	8.12	9.0	ChEMBL
5-HT_5A	5HT5A	Human	5-Hydroxytryptamine	A	pKi	9.0	9.0	9.0	PDSP Ki database
5-HT_5A	5HT5A	Human	5-Hydroxytryptamine	A	pKi	8.5	8.7	8.9	Guide to Pharmacology
5-HT_5A	5HT5A	Rat	5-Hydroxytryptamine	A	pKi	6.84	7.19	7.54	PDSP Ki database
5-HT_5A	5HT5A	Rat	5-Hydroxytryptamine	A	pKi	7.5	7.5	7.5	Guide to Pharmacology
5-HT_5A	5HT5A	Mouse	5-Hydroxytryptamine	A	pKi	6.9	6.97	7.0	PDSP Ki database
5-HT_5A	5HT5A	Mouse	5-Hydroxytryptamine	A	pKi	7.0	7.0	7.0	Guide to Pharmacology
5-HT₆	5HT6R	Rat	5-Hydroxytryptamine	A	pKi	7.0	7.47	8.42	ChEMBL
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pKi	8.39	9.02	9.52	ChEMBL
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pKi	8.85	9.22	9.41	PDSP Ki database
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pKi	8.2	8.8	9.4	Guide to Pharmacology
5-HT₆	5HT6R	Rat	5-Hydroxytryptamine	A	pKi	7.53	8.79	9.42	PDSP Ki database
5-HT₆	5HT6R	Rat	5-Hydroxytryptamine	A	pKi	7.5	8.45	9.4	Guide to Pharmacology
5-HT₆	5HT6R	Mouse	5-Hydroxytryptamine	A	pKi	8.2	8.72	9.25	PDSP Ki database
5-HT₇	5HT7R	Rat	5-Hydroxytryptamine	A	pKi	8.4	8.4	8.4	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pKi	8.4	8.84	9.26	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pKi	8.43	8.5	8.77	PDSP Ki database
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pKi	8.4	8.9	9.4	Guide to Pharmacology
5-HT₇	5HT7R	Mouse	5-Hydroxytryptamine	A	pKi	8.2	8.2	8.2	PDSP Ki database
5-HT₇	5HT7R	Mouse	5-Hydroxytryptamine	A	pKi	8.2	8.2	8.2	Guide to Pharmacology
5-HT₇	5HT7R	Guinea pig	5-Hydroxytryptamine	A	pKi	7.34	7.92	8.43	PDSP Ki database
5-HT₇	5HT7R	Rat	5-Hydroxytryptamine	A	pKi	8.99	9.16	9.42	PDSP Ki database
5-HT₇	5HT7R	Rat	5-Hydroxytryptamine	A	pKi	9.0	9.2	9.4	Guide to Pharmacology
D₁	DRD1	Bovine	Dopamine	A	pKi	6.68	6.68	6.68	PDSP Ki database
D₁	DRD1	Rat	Dopamine	A	pKi	8.7	8.7	8.7	PDSP Ki database
D₁	DRD1	Rat	Dopamine	A	pKi	8.7	8.7	8.7	ChEMBL
D₂	DRD2	Rat	Dopamine	A	pKi	9.4	9.4	9.4	ChEMBL
D₂	DRD2	Bovine	Dopamine	A	pKi	8.85	8.85	8.85	PDSP Ki database
D₂	DRD2	Rat	Dopamine	A	pKi	9.4	9.4	9.4	PDSP Ki database
α_1A	Q9TSW7	Pig	Adrenoceptors	A	pKi	8.1	9.2	10.2	PDSP Ki database
α_1B	A0A4X1U0M4	Pig	Adrenoceptors	A	pKi	9.3	9.3	9.3	PDSP Ki database

Showing 1 to 59 of 59 entries

Search:

Receptor					Activity				Source
GTP No matches found	Uniprot No matches found	Species No matches found	Family No matches found	Class No matches found	Type No matches found	Min	Avg	Max	Database No matches found
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pIC50	7.15	7.15	7.15	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pIC50	7.25	7.25	7.25	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pEC50	9.42	9.42	9.42	ChEMBL
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pIC50	6.9	8.03	8.62	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pEC50	9.22	9.22	9.22	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pIC50	7.68	8.41	9.09	ChEMBL
NPS	NPSR1	Human	Neuropeptide S	A	Potency	4.6	4.6	4.6	ChEMBL
US28	US28	strain AD169	Unclassified	A	pEC50	6.45	6.46	6.46	ChEMBL

Showing 1 to 8 of 8 entries

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methiothepin

Chemical properties

Drug properties

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