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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.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Gastrin/cholecystokinin type B receptor
Species	Mus musculus (Mouse)
Gene	Cckbr
Synonym	CHOLREC Cholecystokinin-2 receptor CCK2-R CCK2 receptor CCK-BR CCK-B/gastrin receptor CCK-B receptor gastrin/cholecystokinin type B receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	453
Amino acid sequence	MDLLKLNRSLQGPGPGSGSSLCRPGVSLLNSSSAGNLSCETPRIRGTGTRELELTIRITLYAVIFLMSVGGNVLIIVVLGLSRRLRTVTNAFLLSLAVSDLLLAVACMPFTLLPNLMGTFIFGTVICKAVSYLMGVSVSVSTLNLAAIALERYSAICRPLQARVWQTRSHAARVILATWLLSGLLMVPYPVYTVVQPVGPRILQCMHLWPSERVQQMWSVLLLILLFFIPGVVMAVAYGLISRELYLGLRFDGDNDSETQSRVRNQGGLPGGAAAPGPVHQNGGCRHVTSLTGEDSDGCYVQLPRSRLEMTTLTTPTTGPGPGPRPNQAKLLAKKRVVRMLLVIVLLFFVCWLPVYSANTWRAFDGPGARRALAGAPISFIHLLSYTSACANPLVYCFMHRRFRQACLDTCARCCPRPPRARPRPLPDEDPPTPSIASLSRLSYTTISTLGPG
UniProt	P56481
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2854
IUPHAR	77
DrugBank	N/A

Ligand

Name	CHEMBL290897
Molecular formula	C26H22BrN3O
IUPAC name	2-[2-(5-bromo-1H-indol-3-yl)ethyl]-3-(4-ethylphenyl)quinazolin-4-one
Molecular weight	472.386
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	5.9
Synonyms	2-[2-(5-Bromo-1H-indol-3-yl)-ethyl]-3-(4-ethyl-phenyl)-3H-quinazolin-4-one BDBM50011957 2-[2-(5-Bromo-1H-indol-3-yl)ethyl]-3-(4-ethylphenyl)quinazolin-4(3H)-one
Inchi Key	BPVZKGLPKFZJAZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H22BrN3O/c1-2-17-7-11-20(12-8-17)30-25(29-24-6-4-3-5-21(24)26(30)31)14-9-18-16-28-23-13-10-19(27)15-22(18)23/h3-8,10-13,15-16,28H,2,9,14H2,1H3
PubChem CID	14843049
ChEMBL	CHEMBL290897
IUPHAR	N/A
BindingDB	50011957
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	28.0 nM	PMID2016728	BindingDB,ChEMBL

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