BindingDB logo
myBDB logout

BDBM50468383 CHEMBL4282481

SMILES: COc1ccc(cc1NS(=O)(=O)c1ccc(OC)c2ccccc12)C(O)=O

InChI Key: InChIKey=IVQPCCOVVQZHMS-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 = 50468383   
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 4 (FABP4)


(Homo sapiens (Human))		BDBM50468383
PNG
(CHEMBL4282481)
Show SMILES COc1ccc(cc1NS(=O)(=O)c1ccc(OC)c2ccccc12)C(O)=O
Show InChI InChI=1S/C19H17NO6S/c1-25-16-9-10-18(14-6-4-3-5-13(14)16)27(23,24)20-15-11-12(19(21)22)7-8-17(15)26-2/h3-11,20H,1-2H3,(H,21,22)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
>6.14E+3n/an/an/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay

Eur J Med Chem 154: 44-59 (2018)


Article DOI: 10.1016/j.ejmech.2018.05.007
BindingDB Entry DOI: 10.7270/Q2BR8VWB
More data for this
Ligand-Target Pair