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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	D(4) dopamine receptor
Species	Homo sapiens (Human)
Gene	DRD4
Synonym	D4 receptor D4R Dopamine D4 receptor dopamine receptor 4 d(2C) dopamine receptor
Disease	Erectile dysfunction Psychotic disorders Schizophrenia
Length	467
Amino acid sequence	MGNRSTADADGLLAGRGPAAGASAGASAGLAGQGAAALVGGVLLIGAVLAGNSLVCVSVATERALQTPTNSFIVSLAAADLLLALLVLPLFVYSEVQGGAWLLSPRLCDALMAMDVMLCTASIFNLCAISVDRFVAVAVPLRYNRQGGSRRQLLLIGATWLLSAAVAAPVLCGLNDVRGRDPAVCRLEDRDYVVYSSVCSFFLPCPLMLLLYWATFRGLQRWEVARRAKLHGRAPRRPSGPGPPSPTPPAPRLPQDPCGPDCAPPAPGLPRGPCGPDCAPAAPGLPPDPCGPDCAPPAPGLPQDPCGPDCAPPAPGLPRGPCGPDCAPPAPGLPQDPCGPDCAPPAPGLPPDPCGSNCAPPDAVRAAALPPQTPPQTRRRRRAKITGRERKAMRVLPVVVGAFLLCWTPFFVVHITQALCPACSVPPRLVSAVTWLGYVNSALNPVIYTVFNAEFRNVFRKALRACC
UniProt	P21917
Protein Data Bank	5wiv, 5wiu
GPCR-HGmod model	P21917
3D structure model	This structure is from PDB ID 5wiv.
BioLiP	BL0394824, BL0394826, BL0394825
Therapeutic Target Database	T24983
ChEMBL	CHEMBL219
IUPHAR	217
DrugBank	BE0009376, BE0000389

Ligand

Name	CHEMBL397770
Molecular formula	C20H20Cl2N2O
IUPAC name	4-(2,3-dichlorophenyl)-1-(1H-indol-3-ylmethyl)piperidin-4-ol
Molecular weight	375.293
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	4.3
Synonyms	1-((1H-indol-3-yl)methyl)-4-(2,3-dichlorophenyl)piperidin-4-ol BDBM50198272 4-(2,3-Dichlorophenyl)-1-[(1H-indol-3-yl)methyl]piperidin-4-ol CTK3F8256 925217-84-1 4-Piperidinol, 4-(2,3-dichlorophenyl)-1-(1H-indol-3-ylmethyl)- DTXSID80659090 AKOS030550425 [ Show all ]
Inchi Key	ASKCQUQTSBOXCM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H20Cl2N2O/c21-17-6-3-5-16(19(17)22)20(25)8-10-24(11-9-20)13-14-12-23-18-7-2-1-4-15(14)18/h1-7,12,23,25H,8-11,13H2
PubChem CID	44438197
ChEMBL	CHEMBL397770
IUPHAR	N/A
BindingDB	50198272
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	1550.0 nM	PMID17095222	BindingDB,ChEMBL

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