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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'RmtA' and Ligand = 'BDBM50376162'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
RmtA


(Emericella nidulans)
BDBM50376162
PNG
(CHEMBL265959)
Show SMILES Oc1c(Br)cc(cc1Br)C(=O)Nc1cccc(NC(=O)c2cc(Br)c(O)c(Br)c2)c1
Show InChI InChI=1S/C20H12Br4N2O4/c21-13-4-9(5-14(22)17(13)27)19(29)25-11-2-1-3-12(8-11)26-20(30)10-6-15(23)18(28)16(24)7-10/h1-8,27-28H,(H,25,29)(H,26,30)
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.14E+4n/an/an/an/an/an/a



Universit£ degli Studi di Roma La Sapienza

Curated by ChEMBL


Assay Description
Inhibition of Aspergillus nidulans RmtA


J Med Chem 51: 2279-90 (2008)


Article DOI: 10.1021/jm701595q
BindingDB Entry DOI: 10.7270/Q28C9X48
More data for this
Ligand-Target Pair