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BDBM50107805 6-Methyl-4'-trifluoromethyl-biphenyl-2-carboxylic acid (7-methanesulfonylamino-6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-amide::CHEMBL343874

SMILES: Cc1cccc(C(=O)Nc2ccc3CCC(CCc3c2)NS(C)(=O)=O)c1-c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=IPKSAVBBDPQPEF-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50107805   
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
Apolipoprotein B-100


(Homo sapiens (Human))
BDBM50107805
PNG
(6-Methyl-4'-trifluoromethyl-biphenyl-2-carboxylic ...)
Show SMILES Cc1cccc(C(=O)Nc2ccc3CCC(CCc3c2)NS(C)(=O)=O)c1-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C27H27F3N2O3S/c1-17-4-3-5-24(25(17)19-6-11-21(12-7-19)27(28,29)30)26(33)31-23-15-9-18-8-13-22(32-36(2,34)35)14-10-20(18)16-23/h3-7,9,11-12,15-16,22,32H,8,10,13-14H2,1-2H3,(H,31,33)
NCI pathway
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KEGG

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PC cid
PC sid
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Similars

PubMed
n/an/a 2.30n/an/an/an/an/an/a



Novartis Institute for Biomedical Reasearch

Curated by ChEMBL


Assay Description
Inhibition of apolipoprotein B (apoB) secreted by human hepatoma cells (Hep G2) at 100 nM


J Med Chem 44: 4677-87 (2001)


BindingDB Entry DOI: 10.7270/Q23F4NXH
More data for this
Ligand-Target Pair
Microsomal triglyceride transfer protein


(Homo sapiens (Human))
BDBM50107805
PNG
(6-Methyl-4'-trifluoromethyl-biphenyl-2-carboxylic ...)
Show SMILES Cc1cccc(C(=O)Nc2ccc3CCC(CCc3c2)NS(C)(=O)=O)c1-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C27H27F3N2O3S/c1-17-4-3-5-24(25(17)19-6-11-21(12-7-19)27(28,29)30)26(33)31-23-15-9-18-8-13-22(32-36(2,34)35)14-10-20(18)16-23/h3-7,9,11-12,15-16,22,32H,8,10,13-14H2,1-2H3,(H,31,33)
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 80n/an/an/an/an/an/a



Novartis Institute for Biomedical Reasearch

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against MTP using MTP transfer assay


J Med Chem 44: 4677-87 (2001)


BindingDB Entry DOI: 10.7270/Q23F4NXH
More data for this
Ligand-Target Pair