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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	G-protein coupled receptor 35
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

Ligand

Name	MLS-0435530.0001
Molecular formula	C27H38N4O3S
IUPAC name	N,N-diethyl-4-(4-methylpiperidin-1-yl)-3-(4-phenylpiperazine-1-carbonyl)benzenesulfonamide
Molecular weight	498.686
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	4.3
Synonyms	BDBM68304 N,N-diethyl-4-(4-methylpiperidino)-3-(4-phenylpiperazine-1-carbonyl)benzenesulfonamide cid_16233035 N,N-diethyl-4-(4-methylpiperidin-1-yl)-3-(4-phenylpiperazin-1-yl)carbonyl-benzenesulfonamide N,N-diethyl-4-(4-methylpiperidin-1-yl)-3-(4-phenylpiperazine-1-carbonyl)benzenesulfonamide CHEMBL1711005 N,N-diethyl-4-(4-methyl-1-piperidinyl)-3-[oxo-(4-phenyl-1-piperazinyl)methyl]benzenesulfonamide [ Show all ]
Inchi Key	DXTSJXPAIJCYKQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H38N4O3S/c1-4-31(5-2)35(33,34)24-11-12-26(29-15-13-22(3)14-16-29)25(21-24)27(32)30-19-17-28(18-20-30)23-9-7-6-8-10-23/h6-12,21-22H,4-5,13-20H2,1-3H3
PubChem CID	16233035
ChEMBL	CHEMBL1711005
IUPHAR	N/A
BindingDB	68304
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

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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