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BDBM50429944 CHEMBL2331584

SMILES: Cc1ccc(cc1)-c1cc(nn1-c1ccccc1)-c1ccccc1OCCCCC(O)=O

InChI Key: InChIKey=ICCHTYMOWLJBJR-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50429944   
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))
BDBM50429944
PNG
(CHEMBL2331584)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccccc1)-c1ccccc1OCCCCC(O)=O
Show InChI InChI=1S/C27H26N2O3/c1-20-14-16-21(17-15-20)25-19-24(28-29(25)22-9-3-2-4-10-22)23-11-5-6-12-26(23)32-18-8-7-13-27(30)31/h2-6,9-12,14-17,19H,7-8,13,18H2,1H3,(H,30,31)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+7n/an/an/an/an/an/a



Okayama University 1-1-1

Curated by ChEMBL


Assay Description
Inhibition of human FABP3 by 8-anilino-1-naphthalenesulfonic acid based fluorescence displacement assay


Bioorg Med Chem Lett 23: 1662-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.01.054
BindingDB Entry DOI: 10.7270/Q29P330P
More data for this
Ligand-Target Pair
Fatty acid-binding protein 4 (FABP4)


(Homo sapiens (Human))
BDBM50429944
PNG
(CHEMBL2331584)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccccc1)-c1ccccc1OCCCCC(O)=O
Show InChI InChI=1S/C27H26N2O3/c1-20-14-16-21(17-15-20)25-19-24(28-29(25)22-9-3-2-4-10-22)23-11-5-6-12-26(23)32-18-8-7-13-27(30)31/h2-6,9-12,14-17,19H,7-8,13,18H2,1H3,(H,30,31)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.59E+5n/an/an/an/an/an/a



Okayama University 1-1-1

Curated by ChEMBL


Assay Description
Inhibition of human FABP4 by 8-anilino-1-naphthalenesulfonic acid based fluorescence displacement assay


Bioorg Med Chem Lett 23: 1662-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.01.054
BindingDB Entry DOI: 10.7270/Q29P330P
More data for this
Ligand-Target Pair