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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.
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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	CHEMBL294394
Molecular formula	C15H19N3
IUPAC name	1-phenyl-4-(1H-pyrrol-2-ylmethyl)piperazine
Molecular weight	241.338
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	2.2
Synonyms	1-Phenyl-4-[(1H-pyrrol-2-yl)methyl]piperazine DTXSID70514604 ZINC13443853 1-Phenyl-4-(1H-pyrrol-2-ylmethyl)-piperazine 2-(4-Phenylpiperazinomethyl)-1H-pyrrole KB-219694 BDBM50115719 1-phenyl-4-(1h-pyrrol-2-ylmethyl)piperazine CTK0J4786 245663-89-2 Piperazine, 1-phenyl-4-(1H-pyrrol-2-ylmethyl)- [ Show all ]
Inchi Key	DCDSVYQQSBWIRG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H19N3/c1-2-6-15(7-3-1)18-11-9-17(10-12-18)13-14-5-4-8-16-14/h1-8,16H,9-13H2
PubChem CID	12997400
ChEMBL	CHEMBL294394
IUPHAR	N/A
BindingDB	50115719
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	100.0 nM	PMID12113813	BindingDB,ChEMBL

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