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BDBM50248243 5-(4-(trifluoromethyl)benzyl)-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-4-carboxylic acid::CHEMBL514654

SMILES: OC(=O)c1cccc2c3CCCCCc3n(Cc3ccc(cc3)C(F)(F)F)c12

InChI Key: InChIKey=GFFFLLHEAMJJMQ-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 = 50248243   
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
Fatty acid binding protein muscle


(Homo sapiens (Human))
BDBM50248243
PNG
(5-(4-(trifluoromethyl)benzyl)-5,6,7,8,9,10-hexahyd...)
Show SMILES OC(=O)c1cccc2c3CCCCCc3n(Cc3ccc(cc3)C(F)(F)F)c12
Show InChI InChI=1S/C22H20F3NO2/c23-22(24,25)15-11-9-14(10-12-15)13-26-19-8-3-1-2-5-16(19)17-6-4-7-18(20(17)26)21(27)28/h4,6-7,9-12H,1-3,5,8,13H2,(H,27,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
Inhibition of human H-FABP by fluorescence polarization assay


Bioorg Med Chem Lett 19: 1745-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.084
BindingDB Entry DOI: 10.7270/Q2TX3F8G
More data for this
Ligand-Target Pair
Fatty acid-binding protein 4 (FABP4)


(Homo sapiens (Human))
BDBM50248243
PNG
(5-(4-(trifluoromethyl)benzyl)-5,6,7,8,9,10-hexahyd...)
Show SMILES OC(=O)c1cccc2c3CCCCCc3n(Cc3ccc(cc3)C(F)(F)F)c12
Show InChI InChI=1S/C22H20F3NO2/c23-22(24,25)15-11-9-14(10-12-15)13-26-19-8-3-1-2-5-16(19)17-6-4-7-18(20(17)26)21(27)28/h4,6-7,9-12H,1-3,5,8,13H2,(H,27,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.03E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
Inhibition of human A-FABP by fluorescence polarization assay


Bioorg Med Chem Lett 19: 1745-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.084
BindingDB Entry DOI: 10.7270/Q2TX3F8G
More data for this
Ligand-Target Pair