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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	4506-71-2
Molecular formula	C11H15NO2S
IUPAC name	ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Molecular weight	225.306
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.3
Synonyms	CDYVTVLXEWMCHU-UHFFFAOYSA-N EN300-03921 ETHYL 2-AMINO-4,5,6,7-TETRAHYDROBENZO[B]THIOPHENE- HMS2383J08 JSPY-st000124 11L-717 methylaminotetrahydrobenzothiophenecarboxylate 2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid ethyl Oprea1_038403 AB0055862 ST005596 AJ-08639 BDBM50202527 Benzo[b]thiophene-3-carboxylicacid, 2-amino-4,5,6,7-tetrahydro-, ethyl ester CJ-00202 Ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate # Ethyl 2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, 99% InChI=1/C11H15NO2S/c1-2-14-11(13)9-7-5-3-4-6-8(7)15-10(9)12/h2-6,12H2,1H3 KB-99904 2-amino-3-ethoxycarbonyl-thienocyclohexane MolPort-000-147-850 3-Benzo[b]thiophenecarboxylic acid, 2-amino-4,5,6,7-hexahydro-, ethyl ester RP27597 AC1Q336S Z7220 ANW-30207 CCG-241304 DTXSID60196372 Ethyl 2-amino-4,5,6,7-tetrahydrobenzo(b)thiophene-3-carboxylate F1443-4671 J-640136 Maybridge1_003467 2-amino-4,5,6,7-tetrahydrobenzo(b)thiophene-3-carboxylic acid ethyl ester NSC-99005 506A712 SCHEMBL133642 ACMC-209k0h ZINC35815 BBL008130 ethyl 2-amino-4, 5, 6, 7-tetrahydrobenzothiophene-3-carboxylate Ethyl 2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate HMS551F13 K-8998 2-Amino-3-carbethoxy-4,5-tetramethylenethiophene MFCD00005862 2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic Acid Ethyl Ester Oprea1_385635 AC1L2UUF STK078621 AKOS000103701 Benzo[b]thiophene-3-carboxylic acid, 2-amino-4,5,6,7-tetrahydro-, ethyl ester BIDD:GT0558 CS-0028339 ethyl 2-amino-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxylate ethyl-2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate J-507811 KS-000010HM 2-amino-4,5,6,7-tetrahydro-benzo[b] thiophene-3-carboxylic acid ethyl ester NCIOpen2_006663 SBB000654 AC1Q336T ZB000975 ARONIS017607 CDYVTVLXEWMCHU-UHFFFAOYSA- EINECS 224-823-1 ethyl 2-amino-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate FT-0635332 J-800140 MCULE-3663812856 2-Amino-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester NSC99005 A4137/0176368 SMR000068930 AE-641/01968005 {Benzo[b]thiophene-3-carboxylic} acid, 2-amino-4,5,6,7-tetrahydro-, ethyl ester BCP06404 CHEMBL338479 Ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Ethyl 2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, 97% I14-16661 KB-19810 2-Amino-3-ethoxycarbonyl-4,5-tetramethylenethiophene MLS000052973 2-MEtene-3-quinuclidinone HCl dihydrate RP13014 AC1Q336R TR-017192 ALBB-001596 Benzo[b]thiophene-3-carboxylic acid,5,6,7-tetrahydro-, ethyl ester CBDivE_002175 CTK4I8613 ethyl 2-amino-4,5,6,7-tetrahydrobenzo(b)-thiophene-3-carboxylate ethyl2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate J-520690 KS-000049ZI 2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid ethyl ester NSC 99005 SC-23795 AC1Q64EG ZERO/004885 BB 0217945 [ Show all ]
Inchi Key	CDYVTVLXEWMCHU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C11H15NO2S/c1-2-14-11(13)9-7-5-3-4-6-8(7)15-10(9)12/h2-6,12H2,1H3
PubChem CID	78262
ChEMBL	CHEMBL338479
IUPHAR	N/A
BindingDB	50202527
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
39693	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
537011	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472
537010	Cannabinoid receptor 2	P34972	CNR2	Homo sapiens (Human)	360
39694	Metabotropic glutamate receptor 5	P41594	GRM5	Homo sapiens (Human)	1212
39695	Metabotropic glutamate receptor 6	O15303	GRM6	Homo sapiens (Human)	877

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