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Name | CX3C chemokine receptor 1 |
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Species | Homo sapiens (Human) |
Gene | CX3CR1 |
Synonym | Beta chemokine receptor-like 1 Rbs11 GPR13 G-protein coupled receptor 13 Fractalkine receptor [ Show all ] |
Disease | N/A |
Length | 355 |
Amino acid sequence | MDQFPESVTENFEYDDLAEACYIGDIVVFGTVFLSIFYSVIFAIGLVGNLLVVFALTNSKKPKSVTDIYLLNLALSDLLFVATLPFWTHYLINEKGLHNAMCKFTTAFFFIGFFGSIFFITVISIDRYLAIVLAANSMNNRTVQHGVTISLGVWAAAILVAAPQFMFTKQKENECLGDYPEVLQEIWPVLRNVETNFLGFLLPLLIMSYCYFRIIQTLFSCKNHKKAKAIKLILLVVIVFFLFWTPYNVMIFLETLKLYDFFPSCDMRKDLRLALSVTETVAFSHCCLNPLIYAFAGEKFRRYLYHLYGKCLAVLCGRSVHVDFSSSESQRSRHGSVLSSNFTYHTSDGDALLLL |
UniProt | P49238 |
Protein Data Bank | N/A |
GPCR-HGmod model | P49238 |
3D structure model | This predicted structure model is from GPCR-EXP P49238. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL4843 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL2349318 |
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Molecular formula | C19H21N5O2S2 |
IUPAC name | 3-[(1S)-1-[[7-[[(2R)-1-hydroxypentan-2-yl]amino]-2-oxo-3H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]ethyl]benzonitrile |
Molecular weight | 415.53 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | 3.7 |
Synonyms | BDBM50432469 SCHEMBL211990 |
Inchi Key | COQNFUICOUPODA-SMDDNHRTSA-N |
Inchi ID | InChI=1S/C19H21N5O2S2/c1-3-5-14(10-25)21-16-15-17(24-19(26)28-15)23-18(22-16)27-11(2)13-7-4-6-12(8-13)9-20/h4,6-8,11,14,25H,3,5,10H2,1-2H3,(H2,21,22,23,24,26)/t11-,14+/m0/s1 |
PubChem CID | 66622526 |
ChEMBL | CHEMBL2349318 |
IUPHAR | N/A |
BindingDB | 50432469 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 14.0 nM | PMID23516963 | BindingDB,ChEMBL |
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