BindingDB logo
myBDB logout

BDBM50082709 5-[4-Hydroxy-4-(4-trifluoromethyl-phenyl)-piperidin-1-yl]-2,2-diphenyl-pentanenitrile::CHEMBL344075

SMILES: OC1(CCN(CCCC(C#N)(c2ccccc2)c2ccccc2)CC1)c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=FFRJRCPNFUAZOW-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50082709   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
C-C chemokine receptor type 1


(Homo sapiens (Human))
BDBM50082709
PNG
(5-[4-Hydroxy-4-(4-trifluoromethyl-phenyl)-piperidi...)
Show SMILES OC1(CCN(CCCC(C#N)(c2ccccc2)c2ccccc2)CC1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H29F3N2O/c30-29(31,32)26-14-12-25(13-15-26)28(35)17-20-34(21-18-28)19-7-16-27(22-33,23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1-6,8-15,35H,7,16-21H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
153n/an/an/an/an/an/an/an/a



Berlex Biosciences

Curated by ChEMBL


Assay Description
Inhibition of [125I]-MIP-1 alpha binding to recombinant human C-C chemokine receptor type 1 expressed in HEK293 cells


J Med Chem 42: 4680-94 (1999)


BindingDB Entry DOI: 10.7270/Q2125TCC
More data for this
Ligand-Target Pair