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Name | G-protein coupled receptor 35 |
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Species | Homo sapiens (Human) |
Gene | GPR35 |
Synonym | G-protein coupled receptor 3 GPR35 KYNA receptor Kynurenic acid receptor |
Disease | N/A |
Length | 309 |
Amino acid sequence | MNGTYNTCGSSDLTWPPAIKLGFYAYLGVLLVLGLLLNSLALWVFCCRMQQWTETRIYMTNLAVADLCLLCTLPFVLHSLRDTSDTPLCQLSQGIYLTNRYMSISLVTAIAVDRYVAVRHPLRARGLRSPRQAAAVCAVLWVLVIGSLVARWLLGIQEGGFCFRSTRHNFNSMAFPLLGFYLPLAVVVFCSLKVVTALAQRPPTDVGQAEATRKAARMVWANLLVFVVCFLPLHVGLTVRLAVGWNACALLETIRRALYITSKLSDANCCLDAICYYYMAKEFQEASALAVAPSAKAHKSQDSLCVTLA |
UniProt | Q9HC97 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q9HC97 |
3D structure model | This predicted structure model is from GPCR-EXP Q9HC97. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL1293267 |
IUPHAR | 102 |
DrugBank | BE0005562 |
Name | MLS-0435539.0001 |
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Molecular formula | C22H28N2O5S2 |
IUPAC name | N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide |
Molecular weight | 464.595 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.8 |
Synonyms | N-(2-methoxy-5-morpholinosulfonyl-phenyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide MCULE-6932739580 Z27831774 AKOS034028907 N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide [ Show all ] |
Inchi Key | DMFJVESKRGCNOS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H28N2O5S2/c1-28-19-9-8-17(31(26,27)24-10-12-29-13-11-24)15-18(19)23-22(25)21-14-16-6-4-2-3-5-7-20(16)30-21/h8-9,14-15H,2-7,10-13H2,1H3,(H,23,25) |
PubChem CID | 16310040 |
ChEMBL | CHEMBL1697974 |
IUPHAR | N/A |
BindingDB | 68313 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | <32000.0 nM | , PubChem BioAssay data set | BindingDB,ChEMBL |
IC50 | <32000.0 nM | , PubChem BioAssay data set | BindingDB,ChEMBL |
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