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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Gonadotropin-releasing hormone receptor
Species	Homo sapiens (Human)
Gene	GNRHR
Synonym	LHRHR GnRH I receptor Type I GnRHR gnRH receptor GnRH-R LHRH receptor GnRHR GNRHR1 luteinizing hormone-releasing hormone (LHRH) receptor luliberin receptor GnRH1 receptor [ Show all ]
Disease	Uterine leiomyoma Hypothalamic hypogonadism Ovulation Prostate cancer Prostate disease Prostate hyperplasia Unspecified Female infertility Esophageal cancer Endometriosis Controlled ovarian stimulation Cancer Advanced prostate cancer Acute lymphoblastic leukemia Hormone deficiency [ Show all ]
Length	328
Amino acid sequence	MANSASPEQNQNHCSAINNSIPLMQGNLPTLTLSGKIRVTVTFFLFLLSATFNASFLLKLQKWTQKKEKGKKLSRMKLLLKHLTLANLLETLIVMPLDGMWNITVQWYAGELLCKVLSYLKLFSMYAPAFMMVVISLDRSLAITRPLALKSNSKVGQSMVGLAWILSSVFAGPQLYIFRMIHLADSSGQTKVFSQCVTHCSFSQWWHQAFYNFFTFSCLFIIPLFIMLICNAKIIFTLTRVLHQDPHELQLNQSKNNIPRARLKTLKMTVAFATSFTVCWTPYYVLGIWYWFDPEMLNRLSDPVNHFFFLFAFLNPCFDPLIYGYFSL
UniProt	P30968
Protein Data Bank	N/A
GPCR-HGmod model	P30968
3D structure model	This predicted structure model is from GPCR-EXP P30968.
BioLiP	N/A
Therapeutic Target Database	T12475
ChEMBL	CHEMBL1855
IUPHAR	256
DrugBank	BE0000203

Ligand

Name	CHEMBL342396
Molecular formula	C31H31ClF3N5O5
IUPAC name	7-chloro-3-(3,5-dimethylphenyl)-2-oxo-4-(2-piperidin-2-ylethoxy)-N-pyrimidin-2-yl-1H-quinoline-6-carboxamide;2,2,2-trifluoroacetic acid
Molecular weight	646.064
Hydrogen bond acceptor	11
Hydrogen bond donor	4
XlogP	None
Synonyms	N/A
Inchi Key	BMXZJFBFLGXCCY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H30ClN5O3.C2HF3O2/c1-17-12-18(2)14-19(13-17)25-26(38-11-7-20-6-3-4-8-31-20)22-15-21(23(30)16-24(22)34-28(25)37)27(36)35-29-32-9-5-10-33-29;3-2(4,5)1(6)7/h5,9-10,12-16,20,31H,3-4,6-8,11H2,1-2H3,(H,34,37)(H,32,33,35,36);(H,6,7)
PubChem CID	49796677
ChEMBL	CHEMBL342396
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available.

Experimental Data

Parameter	Value	Reference	Database source
IC50	<3200.0 nM	PMID10743944	ChEMBL
IC50	290.0 nM	PMID10743944	ChEMBL

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