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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	Rattus norvegicus (Rat)
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	452
Amino acid sequence	MELLKLNRSVQGPGPGSGSSLCRPGVSLLNSSSAGNLSCDPPRIRGTGTRELEMAIRITLYAVIFLMSVGGNVLIIVVLGLSRRLRTVTNAFLLSLAVSDLLLAVACMPFTLLPNLMGTFIFGTVICKAISYLMGVSVSVSTLNLVAIALERYSAICRPLQARVWQTRSHAARVILATWLLSGLLMVPYPVYTMVQPVGPRVLQCMHRWPSARVQQTWSVLLLLLLFFIPGVVIAVAYGLISRELYLGLHFDGENDSETQSRARNQGGLPGGAAPGPVHQNGGCRPVTSVAGEDSDGCCVQLPRSRLEMTTLTTPTPGPVPGPRPNQAKLLAKKRVVRMLLVIVLLFFLCWLPVYSVNTWRAFDGPGAQRALSGAPISFIHLLSYVSACVNPLVYCFMHRRFRQACLDTCARCCPRPPRARPQPLPDEDPPTPSIASLSRLSYTTISTLGPG
UniProt	P30553
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	CHEMBL3508
IUPHAR	77
DrugBank	N/A

Ligand

Name	CHEMBL98809
Molecular formula	C23H27ClN2O
IUPAC name	2-[2-(4-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylpropanamide
Molecular weight	382.932
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	6.1
Synonyms	BDBM50045891 2-[2-(4-Chlorophenyl)-1H-indol-3-yl]-N,N-dipropylpropanamide 2-[2-(4-Chloro-phenyl)-1H-indol-3-yl]-N,N-dipropyl-propionamide
Inchi Key	CQTJTDLYQNYNQU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H27ClN2O/c1-4-14-26(15-5-2)23(27)16(3)21-19-8-6-7-9-20(19)25-22(21)17-10-12-18(24)13-11-17/h6-13,16,25H,4-5,14-15H2,1-3H3
PubChem CID	10249359
ChEMBL	CHEMBL98809
IUPHAR	N/A
BindingDB	50045891
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	<1000.0 nM	PMID8411007	BindingDB,ChEMBL

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