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BDBM83866 1-[4-[1-amino-2-(4-methoxyphenyl)ethyl]-1,3-thiazol-2-yl]-3-(2-benzylphenyl)urea::1-[4-[1-amino-2-(4-methoxyphenyl)ethyl]-2-thiazolyl]-3-[2-(phenylmethyl)phenyl]urea::1-[4-[1-amino-2-(4-methoxyphenyl)ethyl]thiazol-2-yl]-3-(2-benzylphenyl)urea::1-[4-[1-azanyl-2-(4-methoxyphenyl)ethyl]-1,3-thiazol-2-yl]-3-[2-(phenylmethyl)phenyl]urea::MLS003123997::SMR001292272::cid_49786793

SMILES: COc1ccc(CC(N)c2csc(NC(=O)Nc3ccccc3Cc3ccccc3)n2)cc1

InChI Key: InChIKey=SYHJZJGJSPUZSE-UHFFFAOYSA-N

Data: 1 EC50

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 = 83866   
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
FXN frataxin


(Aspergillus niger)		BDBM83866
PNG
(1-[4-[1-amino-2-(4-methoxyphenyl)ethyl]-1,3-thiazo...)
Show SMILES COc1ccc(CC(N)c2csc(NC(=O)Nc3ccccc3Cc3ccccc3)n2)cc1
Show InChI InChI=1S/C26H26N4O2S/c1-32-21-13-11-19(12-14-21)16-22(27)24-17-33-26(29-24)30-25(31)28-23-10-6-5-9-20(23)15-18-7-3-2-4-8-18/h2-14,17,22H,15-16,27H2,1H3,(H2,28,29,30,31)
UniProtKB/SwissProt

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AffyNet 
PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/an/an/a>5.97E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute, TS...

PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2PK0DN5
More data for this
Ligand-Target Pair