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Found 1 hit Enz. Inhib. hit(s) with Target = 'Protein-arginine deiminase type-2' and Ligand = 'BDBM50204603'   
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
Protein-arginine deiminase type-2


(Homo sapiens (Human))		BDBM50204603
PNG
(CHEMBL3907951)
Show SMILES COc1cc(cc2nc(-c3cc4ccccc4n3CC(F)(F)F)n(C)c12)C(=O)N1CCC[C@@H](N)C1 |r|
Show InChI InChI=1S/C25H26F3N5O2/c1-31-22-18(10-16(12-21(22)35-2)24(34)32-9-5-7-17(29)13-32)30-23(31)20-11-15-6-3-4-8-19(15)33(20)14-25(26,27)28/h3-4,6,8,10-12,17H,5,7,9,13-14,29H2,1-2H3/t17-/m1/s1
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PC cid
PC sid
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Similars
Article
PubMed
n/an/a<7.94E+4n/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/FLAG-tagged recombinant human PAD2 (1 to 665 residues) expressed in baculovirus infected sf9 cells using N-a-benzoyl-L-...

ACS Med Chem Lett 8: 19-21 (2017)


Article DOI: 10.1021/acsmedchemlett.6b00515
BindingDB Entry DOI: 10.7270/Q20V8FSZ
More data for this
Ligand-Target Pair