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GPCR

NameC-C chemokine receptor-like 2
SpeciesHomo sapiens (Human)
GeneCCRL2
SynonymACR5
CRAM-B
CRAM-A
CKRX
Chemokine receptor X
[ Show all ]
DiseaseN/A
Length344
Amino acid sequenceMANYTLAPEDEYDVLIEGELESDEAEQCDKYDAQALSAQLVPSLCSAVFVIGVLDNLLVVLILVKYKGLKRVENIYLLNLAVSNLCFLLTLPFWAHAGGDPMCKILIGLYFVGLYSETFFNCLLTVQRYLVFLHKGNFFSARRRVPCGIITSVLAWVTAILATLPEFVVYKPQMEDQKYKCAFSRTPFLPADETFWKHFLTLKMNISVLVLPLFIFTFLYVQMRKTLRFREQRYSLFKLVFAIMVVFLLMWAPYNIAFFLSTFKEHFSLSDCKSSYNLDKSVHITKLIATTHCCINPLLYAFLDGTFSKYLCRCFHLRSNTPLQPRGQSAQGTSREEPDHSTEV
UniProtO00421
Protein Data BankN/A
GPCR-HGmod modelO00421
3D structure modelThis predicted structure model is from GPCR-EXP O00421.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2321627
IUPHARN/A
DrugBankN/A

Ligand

NameSCHEMBL9999319
Molecular formulaC23H29F3N6O2
IUPAC nameN-ethyl-4-[3-[[2-[[6-(trifluoromethyl)quinazolin-4-yl]amino]acetyl]amino]azetidin-1-yl]cyclohexane-1-carboxamide
Molecular weight478.52
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP2.9
SynonymsN-ethyl-4-(3-(2-((6-(trifluoromethyl)quinazolin-4-yl)amino)acetamido)azetidin-1-yl)cyclohexanecarboxamide
CHEMBL3704135
BDBM163500
LTFZAEGSTMTPGB-UHFFFAOYSA-N
US9062048, 127
Inchi KeyLTFZAEGSTMTPGB-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H29F3N6O2/c1-2-27-22(34)14-3-6-17(7-4-14)32-11-16(12-32)31-20(33)10-28-21-18-9-15(23(24,25)26)5-8-19(18)29-13-30-21/h5,8-9,13-14,16-17H,2-4,6-7,10-12H2,1H3,(H,27,34)(H,31,33)(H,28,29,30)
PubChem CID54769306
ChEMBLCHEMBL3704135
IUPHARN/A
BindingDB163500
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC50200.0 nM, NoneBindingDB,ChEMBL

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