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Name | Chemokine-like receptor 1 |
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Species | Homo sapiens (Human) |
Gene | CMKLR1 |
Synonym | tazarotene induced gene 2 receptor RVER1 resolvin E1 receptor Gpcr27 G-protein coupled receptor DEZ [ Show all ] |
Disease | N/A |
Length | 373 |
Amino acid sequence | MRMEDEDYNTSISYGDEYPDYLDSIVVLEDLSPLEARVTRIFLVVVYSIVCFLGILGNGLVIIIATFKMKKTVNMVWFLNLAVADFLFNVFLPIHITYAAMDYHWVFGTAMCKISNFLLIHNMFTSVFLLTIISSDRCISVLLPVWSQNHRSVRLAYMACMVIWVLAFFLSSPSLVFRDTANLHGKISCFNNFSLSTPGSSSWPTHSQMDPVGYSRHMVVTVTRFLCGFLVPVLIITACYLTIVCKLQRNRLAKTKKPFKIIVTIIITFFLCWCPYHTLNLLELHHTAMPGSVFSLGLPLATALAIANSCMNPILYVFMGQDFKKFKVALFSRLVNALSEDTGHSSYPSHRSFTKMSSMNERTSMNERETGML |
UniProt | Q99788 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q99788 |
3D structure model | This predicted structure model is from GPCR-EXP Q99788. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL3540 |
IUPHAR | 79 |
DrugBank | N/A |
Name | CHEMBL3964891 |
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Molecular formula | C28H29F8N3O2 |
IUPAC name | (3R,4S)-N-[3,5-bis(trifluoromethyl)phenyl]-3-[(4,4-difluoropiperidin-1-yl)methyl]-1-(2,6-dimethylphenyl)-4-methyl-5-oxopyrrolidine-3-carboxamide |
Molecular weight | 591.546 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 1 |
XlogP | 5.9 |
Synonyms | SCHEMBL15251182 |
Inchi Key | AECVBIBPXYUBRU-IQGLISFBSA-N |
Inchi ID | InChI=1S/C28H29F8N3O2/c1-16-5-4-6-17(2)22(16)39-15-25(18(3)23(39)40,14-38-9-7-26(29,30)8-10-38)24(41)37-21-12-19(27(31,32)33)11-20(13-21)28(34,35)36/h4-6,11-13,18H,7-10,14-15H2,1-3H3,(H,37,41)/t18-,25-/m1/s1 |
PubChem CID | 89799820 |
ChEMBL | CHEMBL3964891 |
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. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 30.0 nM | None | ChEMBL |
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