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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 | MLS000581649 |
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Molecular formula | C19H18N4O3S |
IUPAC name | N-(1,3-benzothiazol-2-yl)-3-nitro-4-piperidin-1-ylbenzamide |
Molecular weight | 382.438 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.3 |
Synonyms | ZINC5027992 AC1MGNNQ N-(1,3-benzothiazol-2-yl)-3-nitro-4-piperidin-1-yl-benzamide N-1,3-benzothiazol-2-yl-3-nitro-4-(1-piperidinyl)benzamide HMS2549F07 [ Show all ] |
Inchi Key | CBNOIGRBFUWGEN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H18N4O3S/c24-18(21-19-20-14-6-2-3-7-17(14)27-19)13-8-9-15(16(12-13)23(25)26)22-10-4-1-5-11-22/h2-3,6-9,12H,1,4-5,10-11H2,(H,20,21,24) |
PubChem CID | 2963825 |
ChEMBL | CHEMBL1547464 |
IUPHAR | N/A |
BindingDB | 61611 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 1119.73 nM | , PubChem BioAssay data set | BindingDB,ChEMBL |
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