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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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GPCR

NameC-C chemokine receptor type 1
SpeciesHomo sapiens (Human)
GeneCCR1
SynonymMIP-1alpha-R
C-C CKR-1
CCR1
RANTES-R
MIP-1alphaR
[ Show all ]
DiseaseAutoimmune diabetes
Chronic obstructive pulmonary disease
Rheumatoid arthritis
Length355
Amino acid sequenceMETPNTTEDYDTTTEFDYGDATPCQKVNERAFGAQLLPPLYSLVFVIGLVGNILVVLVLVQYKRLKNMTSIYLLNLAISDLLFLFTLPFWIDYKLKDDWVFGDAMCKILSGFYYTGLYSEIFFIILLTIDRYLAIVHAVFALRARTVTFGVITSIIIWALAILASMPGLYFSKTQWEFTHHTCSLHFPHESLREWKLFQALKLNLFGLVLPLLVMIICYTGIIKILLRRPNEKKSKAVRLIFVIMIIFFLFWTPYNLTILISVFQDFLFTHECEQSRHLDLAVQVTEVIAYTHCCVNPVIYAFVGERFRKYLRQLFHRRVAVHLVKWLPFLSVDRLERVSSTSPSTGEHELSAGF
UniProtP32246
Protein Data BankN/A
GPCR-HGmod modelP32246
3D structure modelThis predicted structure model is from GPCR-EXP P32246.
BioLiPN/A
Therapeutic Target DatabaseT16016
ChEMBLCHEMBL2413
IUPHAR58
DrugBankN/A

Ligand

Name1,10-phenanthroline
Molecular formulaC12H8N2
IUPAC name1,10-phenanthroline
Molecular weight180.21
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP1.8
Synonyms(OP)2Cu(I)
.beta.-Phenanthroline
011P678
1,1 0-phenanthroline
1,10 CPhenanthroline anhydrous
[ Show all ]
Inchi KeyDGEZNRSVGBDHLK-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H
PubChem CID1318
ChEMBLCHEMBL415879
IUPHARN/A
BindingDB50092158
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC505900.0 nMPMID22957890BindingDB,ChEMBL
EC506309.57 nMPMID22957890BindingDB,ChEMBL
FC5.5 -PMID22957890ChEMBL
IC5074000.0 nMPMID22957890BindingDB,ChEMBL
IC5079432.8 nMPMID22957890BindingDB,ChEMBL
Inhibition335.0 %PMID22957890ChEMBL

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