Found 3 hits in this display Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50441752
(CHEMBL2435894)Show SMILES CC(CCNC(=O)c1c(C)ncnc1C)N1CCC(CC1)N1C(CN(C2CCCCC2)C1=O)c1cccc(c1)C#N Show InChI InChI=1S/C32H43N7O2/c1-22(12-15-34-31(40)30-23(2)35-21-36-24(30)3)37-16-13-28(14-17-37)39-29(26-9-7-8-25(18-26)19-33)20-38(32(39)41)27-10-5-4-6-11-27/h7-9,18,21-22,27-29H,4-6,10-17,20H2,1-3H3,(H,34,40) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanofi
Curated by ChEMBL
| Assay Description
Antagonist activity at CCR5 (unknown origin) expressed in HEK293F cell membranes assessed as inhibition of RANTES-induced calcium flux preincubated f... |
J Med Chem 56: 8049-65 (2013)
Article DOI: 10.1021/jm401101p
BindingDB Entry DOI: 10.7270/Q2445NX3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50441752
(CHEMBL2435894)Show SMILES CC(CCNC(=O)c1c(C)ncnc1C)N1CCC(CC1)N1C(CN(C2CCCCC2)C1=O)c1cccc(c1)C#N Show InChI InChI=1S/C32H43N7O2/c1-22(12-15-34-31(40)30-23(2)35-21-36-24(30)3)37-16-13-28(14-17-37)39-29(26-9-7-8-25(18-26)19-33)20-38(32(39)41)27-10-5-4-6-11-27/h7-9,18,21-22,27-29H,4-6,10-17,20H2,1-3H3,(H,34,40) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanofi
Curated by ChEMBL
| Assay Description
Displacement of [125I]-RANTES from CCR5 (unknown origin) expressed in HEK293F cell membranes after 45 mins by microbeta jet liquid scintillation coun... |
J Med Chem 56: 8049-65 (2013)
Article DOI: 10.1021/jm401101p
BindingDB Entry DOI: 10.7270/Q2445NX3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50441752
(CHEMBL2435894)Show SMILES CC(CCNC(=O)c1c(C)ncnc1C)N1CCC(CC1)N1C(CN(C2CCCCC2)C1=O)c1cccc(c1)C#N Show InChI InChI=1S/C32H43N7O2/c1-22(12-15-34-31(40)30-23(2)35-21-36-24(30)3)37-16-13-28(14-17-37)39-29(26-9-7-8-25(18-26)19-33)20-38(32(39)41)27-10-5-4-6-11-27/h7-9,18,21-22,27-29H,4-6,10-17,20H2,1-3H3,(H,34,40) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 57 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanofi
Curated by ChEMBL
| Assay Description
Inhibition of CCR5 (unknown origin) expressed in human HeLa cells assessed as inhibition of interaction of CHO cells expressing HIV-1 JRFLenv and HIV... |
J Med Chem 56: 8049-65 (2013)
Article DOI: 10.1021/jm401101p
BindingDB Entry DOI: 10.7270/Q2445NX3 |
More data for this
Ligand-Target Pair | |