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Name | Substance-P receptor |
---|---|
Species | Rattus norvegicus (Rat) |
Gene | Tacr1 |
Synonym | TAC1R Substance P receptor SPR NK1R NK1 receptor [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 407 |
Amino acid sequence | MDNVLPMDSDLFPNISTNTSESNQFVQPTWQIVLWAAAYTVIVVTSVVGNVVVIWIILAHKRMRTVTNYFLVNLAFAEACMAAFNTVVNFTYAVHNVWYYGLFYCKFHNFFPIAALFASIYSMTAVAFDRYMAIIHPLQPRLSATATKVVIFVIWVLALLLAFPQGYYSTTETMPSRVVCMIEWPEHPNRTYEKAYHICVTVLIYFLPLLVIGYAYTVVGITLWASEIPGDSSDRYHEQVSAKRKVVKMMIVVVCTFAICWLPFHVFFLLPYINPDLYLKKFIQQVYLASMWLAMSSTMYNPIIYCCLNDRFRLGFKHAFRCCPFISAGDYEGLEMKSTRYLQTQSSVYKVSRLETTISTVVGAHEEEPEEGPKATPSSLDLTSNGSSRSNSKTMTESSSFYSNMLA |
UniProt | P14600 |
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 | CHEMBL4027 |
IUPHAR | 360 |
DrugBank | N/A |
Name | CHEMBL3609619 |
---|---|
Molecular formula | C32H30F6N4O5 |
IUPAC name | [3,5-bis(trifluoromethyl)phenyl]methyl (2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoate |
Molecular weight | 664.605 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 5 |
XlogP | 4.5 |
Synonyms | N/A |
Inchi Key | ADPQCWUGLGBPRO-ISCRSJHHSA-N |
Inchi ID | InChI=1S/C32H30F6N4O5/c1-17(41-29(45)25(39)12-18-6-8-23(43)9-7-18)28(44)42-27(13-20-15-40-26-5-3-2-4-24(20)26)30(46)47-16-19-10-21(31(33,34)35)14-22(11-19)32(36,37)38/h2-11,14-15,17,25,27,40,43H,12-13,16,39H2,1H3,(H,41,45)(H,42,44)/t17-,25+,27+/m1/s1 |
PubChem CID | 44176458 |
ChEMBL | CHEMBL3609619 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 2.9 nM | PMID26212775 | ChEMBL |
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