Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor XI' and Ligand = 'BDBM303812'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Coagulation factor XI (Homo sapiens (Human))	BDBM303812 (2-(11′-Chloro-2′,5′-dioxo-2̸...) Show SMILES Cn1cc2cc(NC(=O)C(Cc3ccccc3)n3cc4c(cc3=O)-c3cc(Cl)ccc3CC3(CC3)NC4=O)ccc2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;$| Show InChI InChI=1S/C33H28ClN5O3/c1-38-18-22-14-24(9-10-28(22)37-38)35-32(42)29(13-20-5-3-2-4-6-20)39-19-27-26(16-30(39)40)25-15-23(34)8-7-21(25)17-33(11-12-33)36-31(27)41/h2-10,14-16,18-19,29H,11-13,17H2,1H3,(H,35,42)(H,36,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
BAYER PHARMA AKTIENGESELLSCHAFT US Patent					Assay Description The factor XIa inhibition of the substances according to the invention is determined using a biochemical test system which utilizes the reaction of a...				US Patent US10138236 (2018) BindingDB Entry DOI: 10.7270/Q2445PH4
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