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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ADAMTS5' and Ligand = 'BDBM379701'   
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
ADAMTS5


(Rattus norvegicus (Rat))		BDBM379701
PNG
(US9926281, Compound 314)
Show SMILES CC(CC1(NC(=O)NC1=O)C1CC1)C(=O)N1CCN([C@@H](C)C1)c1cncc(Cl)c1 |r|
Show InChI InChI=1S/C20H26ClN5O3/c1-12(8-20(14-3-4-14)18(28)23-19(29)24-20)17(27)25-5-6-26(13(2)11-25)16-7-15(21)9-22-10-16/h7,9-10,12-14H,3-6,8,11H2,1-2H3,(H2,23,24,28,29)/t12?,13-,20?/m0/s1
PDB

UniProtKB/TrEMBL

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PC cid
PC sid
UniChem
US Patent
n/an/a 34n/an/an/an/an/an/a



University of Illinois at Chicago



Assay Description
ADAMTS-4:The basis for the assay is the cleavage of the substrate TBIS-1 (5-FAM-TEGEARGSVILLK (5TAMRA)K-NH2) (SEQ ID No 2) by human ADAMTS4For the do...

J Med Chem 51: 3437-48 (2008)


BindingDB Entry DOI: 10.7270/Q27S7R3T
More data for this
Ligand-Target Pair