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SMILES: FC(F)c1nn(Cc2cn3cc(ccc3n2)C2CC2)cc1C(=O)NCc1ncn2ccc(Cl)cc12

InChI Key: InChIKey=XWYZQCXTNXOARS-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 455075   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Plasma kallikrein (Homo sapiens (Human))	BDBM455075 (US10730874, Compound I-99 | US11352356, Compound I...) Show SMILES FC(F)c1nn(Cc2cn3cc(ccc3n2)C2CC2)cc1C(=O)NCc1ncn2ccc(Cl)cc12 Show InChI InChI=1S/C24H20ClF2N7O/c25-16-5-6-32-13-29-19(20(32)7-16)8-28-24(35)18-12-34(31-22(18)23(26)27)11-17-10-33-9-15(14-1-2-14)3-4-21(33)30-17/h3-7,9-10,12-14,23H,1-2,8,11H2,(H,28,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	<1	n/a	n/a	n/a	n/a
TBA					Assay Description Example compounds were evaluated for inhibition of the human activated kallikrein enzyme in two formats of an assay employing a fluorogenic peptide s...				Citation and Details BindingDB Entry DOI: 10.7270/Q2W95DCK
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM455075 (US10730874, Compound I-99 | US11352356, Compound I...) Show SMILES FC(F)c1nn(Cc2cn3cc(ccc3n2)C2CC2)cc1C(=O)NCc1ncn2ccc(Cl)cc12 Show InChI InChI=1S/C24H20ClF2N7O/c25-16-5-6-32-13-29-19(20(32)7-16)8-28-24(35)18-12-34(31-22(18)23(26)27)11-17-10-33-9-15(14-1-2-14)3-4-21(33)30-17/h3-7,9-10,12-14,23H,1-2,8,11H2,(H,28,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	<1	n/a	n/a	n/a	n/a
Shire Human Genetic Therapies, Inc. US Patent					Assay Description Example compounds were evaluated for inhibition of the human activated kallikrein enzyme in two formats of an assay employing a fluorogenic peptide s...				US Patent US10730874 (2020) BindingDB Entry DOI: 10.7270/Q2RN3BXC
					More data for this Ligand-Target Pair