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Name | Trace amine-associated receptor 1 |
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Species | Rattus norvegicus (Rat) |
Gene | Taar1 |
Synonym | TA1 receptor TaR-1 TAR1 Trace amine receptor 1 TRAR1 |
Disease | N/A for non-human GPCRs |
Length | 332 |
Amino acid sequence | MHLCHNSANISHTNSNWSRDVRASLYSLISLIILTTLVGNLIVIISISHFKQLHTPTNWLLHSMAVVDFLLGCLVMPYSMVRTVEHCWYFGELFCKLHTSTDIMLSSASILHLAFISIDRYYAVCDPLRYKAKINLAAIFVMILISWSLPAVFAFGMIFLELNLEGVEELYHNQVFCLRGCFPFFSKVSGVLAFMTSFYIPGSVMLFVYYRIYFIAKGQARSINRANLQVGLEGESRAPQSKETKAAKTLGIMVGVFLLCWCPFFFCMVLDPFLGYVIPPTLNDTLNWFGYLNSAFNPMVYAFFYPWFRRALKMVLFGKIFQKDSSRSKLFL |
UniProt | Q923Y9 |
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 | CHEMBL3833 |
IUPHAR | 364 |
DrugBank | N/A |
Name | CHEMBL3672989 |
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Molecular formula | C19H17ClF2N4O3 |
IUPAC name | 1-[2-chloro-4-[(2R)-morpholin-2-yl]phenyl]-3-[5-cyano-2-(difluoromethoxy)phenyl]urea |
Molecular weight | 422.817 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 2.8 |
Synonyms | BDBM158253 SCHEMBL14151202 US9029370, 47 |
Inchi Key | BZPDPMRSUULMIB-KRWDZBQOSA-N |
Inchi ID | InChI=1S/C19H17ClF2N4O3/c20-13-8-12(17-10-24-5-6-28-17)2-3-14(13)25-19(27)26-15-7-11(9-23)1-4-16(15)29-18(21)22/h1-4,7-8,17-18,24H,5-6,10H2,(H2,25,26,27)/t17-/m0/s1 |
PubChem CID | 71087095 |
ChEMBL | CHEMBL3672989 |
IUPHAR | N/A |
BindingDB | 158253 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 1.2 nM | , None | BindingDB,ChEMBL |
Ki | 1.8 nM | None | ChEMBL |
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