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BDBM50175729 4-(1-benzyl-1H-imidazol-2-yl)-N-(4-fluorophenyl)-4-phenylpiperidine-1-carboxamide::CHEMBL201453

SMILES: Fc1ccc(NC(=O)N2CCC(CC2)(c2nccn2Cc2ccccc2)c2ccccc2)cc1

InChI Key: InChIKey=ZEGZOWUJKQECPQ-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50175729   
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
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50175729
PNG
(4-(1-benzyl-1H-imidazol-2-yl)-N-(4-fluorophenyl)-4...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)(c2nccn2Cc2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C28H27FN4O/c29-24-11-13-25(14-12-24)31-27(34)32-18-15-28(16-19-32,23-9-5-2-6-10-23)26-30-17-20-33(26)21-22-7-3-1-4-8-22/h1-14,17,20H,15-16,18-19,21H2,(H,31,34)
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CHEMBL
PC cid
PC sid
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Similars

Article
PubMed
97n/an/an/an/an/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from cloned human delta opioid receptor


Bioorg Med Chem Lett 16: 146-9 (2005)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50175729
PNG
(4-(1-benzyl-1H-imidazol-2-yl)-N-(4-fluorophenyl)-4...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)(c2nccn2Cc2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C28H27FN4O/c29-24-11-13-25(14-12-24)31-27(34)32-18-15-28(16-19-32,23-9-5-2-6-10-23)26-30-17-20-33(26)21-22-7-3-1-4-8-22/h1-14,17,20H,15-16,18-19,21H2,(H,31,34)
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PC sid
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Article
PubMed
148n/an/an/an/an/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from cloned human kappa opioid receptor


Bioorg Med Chem Lett 16: 146-9 (2005)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50175729
PNG
(4-(1-benzyl-1H-imidazol-2-yl)-N-(4-fluorophenyl)-4...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)(c2nccn2Cc2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C28H27FN4O/c29-24-11-13-25(14-12-24)31-27(34)32-18-15-28(16-19-32,23-9-5-2-6-10-23)26-30-17-20-33(26)21-22-7-3-1-4-8-22/h1-14,17,20H,15-16,18-19,21H2,(H,31,34)
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Article
PubMed
1.21E+3n/an/an/an/an/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from cloned human mu opioid receptor


Bioorg Med Chem Lett 16: 146-9 (2005)

More data for this
Ligand-Target Pair