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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

NameSCHEMBL9999089
Molecular formulaC25H28F3N7O
IUPAC nameN-[1-[4-(5-aminopyridin-2-yl)cyclohexyl]azetidin-3-yl]-2-[[6-(trifluoromethyl)quinazolin-4-yl]amino]acetamide
Molecular weight499.542
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogP3.3
SynonymsCHEMBL3704087
BDBM163443
FUAYIRBDAPBFDO-UHFFFAOYSA-N
US9062048, 70
N-(1-(4-(5-aminopyridin-2-yl)cyclohexyl)azetidin-3-yl)-2-((6-(trifluoromethyl)quinazolin-4-yl)amino)acetamide
Inchi KeyFUAYIRBDAPBFDO-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H28F3N7O/c26-25(27,28)16-3-7-22-20(9-16)24(33-14-32-22)31-11-23(36)34-18-12-35(13-18)19-5-1-15(2-6-19)21-8-4-17(29)10-30-21/h3-4,7-10,14-15,18-19H,1-2,5-6,11-13,29H2,(H,34,36)(H,31,32,33)
PubChem CID54772207
ChEMBLCHEMBL3704087
IUPHARN/A
BindingDB163443
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC509.0 nM, NoneBindingDB,ChEMBL

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