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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Complement C1s subcomponent' and Ligand = 'BDBM50099898'   
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
Complement C1s subcomponent


(Homo sapiens (Human))
BDBM50099898
PNG
(4-[4-(2-Methoxy-phenyl)-thiazol-2-yl]-5-methylsulf...)
Show SMILES COc1ccccc1-c1csc(n1)-c1cc(sc1SC)C(N)=N
Show InChI InChI=1S/C16H15N3OS3/c1-20-12-6-4-3-5-9(12)11-8-22-15(19-11)10-7-13(14(17)18)23-16(10)21-2/h3-8H,1-2H3,(H3,17,18)
PDB
MMDB

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Article
PubMed
850n/an/an/an/an/an/an/an/a



3-Dimensional Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Complement C1s subcomponent


Bioorg Med Chem Lett 14: 3043-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.034
BindingDB Entry DOI: 10.7270/Q2K35T33
More data for this
Ligand-Target Pair