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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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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-0437448.0001
Molecular formula	C11H11N5S
IUPAC name	[(E)-(5-phenyl-1H-pyrazol-4-yl)methylideneamino]thiourea
Molecular weight	245.304
Hydrogen bond acceptor	3
Hydrogen bond donor	3
XlogP	1.2
Synonyms	AB00091735-01 cid_5335766 [[(Z)-(3-phenyl-4-pyrazolylidene)methyl]amino]thiourea AC1OA2P0 MolPort-002-117-205 1-[[(Z)-(3-phenylpyrazol-4-ylidene)methyl]amino]thiourea [(3-phenylpyrazol-4-ylidene)methylamino]thiourea AC1NSL0H HMS1583O17 [[(Z)-(3-phenylpyrazol-4-ylidene)methyl]amino]thiourea AKOS005444153 ST50912622 CHEMBL1701030 [[(E)-(3-phenylpyrazol-4-ylidene)methyl]amino]thiourea AC1NTZ84 {[(1E)-2-(3-phenylpyrazol-4-yl)-1-azavinyl]amino}aminomethane-1-thione (2E)-2-[(3-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinecarbothioamide BDBM75871 STK368665 [ Show all ]
Inchi Key	CNUFVDRGRFSWEU-VGOFMYFVSA-N
Inchi ID	InChI=1S/C11H11N5S/c12-11(17)16-14-7-9-6-13-15-10(9)8-4-2-1-3-5-8/h1-7H,(H,13,15)(H3,12,16,17)/b14-7+
PubChem CID	135446678
ChEMBL	CHEMBL1701030
IUPHAR	N/A
BindingDB	75871
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	<32000.0 nM	, PubChem BioAssay data set	BindingDB,ChEMBL

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