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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 |
Name | 158985-00-3 |
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Molecular formula | C18H19ClN4 |
IUPAC name | 3-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine |
Molecular weight | 326.828 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 3.4 |
Synonyms | NCGC00015588-05 Tocris-1002 3-((4-(4-chlorophenyl)piperazin-1-yl)methyl)-1H-pyrrolo(2,3-b)pyridine API0003103 CCG-204875 [ Show all ] |
Inchi Key | OGJGQVFWEPNYSB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H19ClN4/c19-15-3-5-16(6-4-15)23-10-8-22(9-11-23)13-14-12-21-18-17(14)2-1-7-20-18/h1-7,12H,8-11,13H2,(H,20,21) |
PubChem CID | 5311200 |
ChEMBL | CHEMBL267014 |
IUPHAR | 3303 |
BindingDB | 85093 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Activity | 20.0 % | PMID15084133 | ChEMBL |
EC50 | 27.0 nM | PMID11844688 | BindingDB,ChEMBL |
EC50 | 2230.0 nM | PMID15084133 | BindingDB,ChEMBL |
IC50 | 1.0 nM | PMID9873481 | BindingDB |
IC50 | 5.0 nM | PMID9873481 | BindingDB |
Intrinsic activity | 24.0 % | PMID11844688 | ChEMBL |
Ki | 0.39 nM | PMID8642550 | IUPHAR |
Ki | 0.4 nM | PMID15084133 | BindingDB,ChEMBL |
Ki | 0.43 nM | PMID19155177 | PDSP |
Ki | 0.43 nM | PMID11378358, PMID15501032, PMID10098669 | BindingDB |
Ki | 0.43 nM | PMID11170639, PMID9822559, PMID19155177, PMID8642550, PMID11378358, PMID10098669 | BindingDB,ChEMBL |
Ki | 0.43 nM | PMID11170639 | BindingDB |
Ki | 0.6 nM | PMID9990464 | ChEMBL |
Ki | 0.6 nM | PMID9990464 | BindingDB |
Ki | 0.6166 nM | PMID17266201 | ChEMBL |
Ki | 0.62 nM | PMID11844688, PMID19481941 | ChEMBL |
Ki | 0.62 nM | PMID11844688 | BindingDB |
Ki | 0.91 nM | PMID10602703, PMID9873377 | BindingDB,ChEMBL |
Ki | 0.91 nM | PMID9873377 | BindingDB |
Ki | 1.8 nM | PMID16135699 | PDSP,BindingDB |
Ki | 11.7 nM | PMID9223553 | BindingDB |
Log Ki | 9.21 D4 | PMID11312915 | ChEMBL |
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