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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 | SCHEMBL1992715 |
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Molecular formula | C20H18ClN3O |
IUPAC name | 1-chloro-N-(4-pyrrolidin-3-ylphenyl)isoquinoline-3-carboxamide |
Molecular weight | 351.834 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 4.0 |
Synonyms | US9452980, 108 3-Isoquinolinecarboxamide, 1-chloro-N-[4-(3-pyrrolidinyl)phenyl]- CHEMBL3953959 1312567-62-6 BDBM250198 |
Inchi Key | CRXUAVINIRWJJJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H18ClN3O/c21-19-17-4-2-1-3-14(17)11-18(24-19)20(25)23-16-7-5-13(6-8-16)15-9-10-22-12-15/h1-8,11,15,22H,9-10,12H2,(H,23,25) |
PubChem CID | 53251264 |
ChEMBL | CHEMBL3953959 |
IUPHAR | N/A |
BindingDB | 250198 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 8.1 nM | , None | BindingDB,ChEMBL |
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