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SMILES: COc1c(O)cccc1-c1nnn(CCC(=O)OCC(=O)c2ccccc2)n1

InChI Key: InChIKey=PNTJSSYHRIMMHB-UHFFFAOYSA-N

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 = 79639   
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
Tropomyosin alpha-1 chain


(Sus scrofa)		BDBM79639
PNG
(3-[5-(3-Hydroxy-2-methoxy-phenyl)-tetrazol-2-yl]-p...)
Show SMILES COc1c(O)cccc1-c1nnn(CCC(=O)OCC(=O)c2ccccc2)n1
Show InChI InChI=1S/C19H18N4O5/c1-27-18-14(8-5-9-15(18)24)19-20-22-23(21-19)11-10-17(26)28-12-16(25)13-6-3-2-4-7-13/h2-9,24H,10-12H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>7.15E+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 (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...

PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q21N7ZKB
More data for this
Ligand-Target Pair