null

SMILES: Fc1c(Cl)ccn2cnc(CNC(=O)c3cn(Cc4cn5cc(cc(-n6cn[nH]c(=O)c6=O)c5n4)C4CC4)nn3)c12

InChI Key: InChIKey=NFRQQTRYGIYGMO-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 455236   

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))	BDBM455236 (US10730874, Compound I-247 | US11352356, Compound ...) Show SMILES Fc1c(Cl)ccn2cnc(CNC(=O)c3cn(Cc4cn5cc(cc(-n6cn[nH]c(=O)c6=O)c5n4)C4CC4)nn3)c12 Show InChI InChI=1S/C25H19ClFN11O3/c26-16-3-4-35-11-29-17(21(35)20(16)27)6-28-23(39)18-10-37(34-32-18)9-15-8-36-7-14(13-1-2-13)5-19(22(36)31-15)38-12-30-33-24(40)25(38)41/h3-5,7-8,10-13H,1-2,6,9H2,(H,28,39)(H,33,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	<1	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM455236 (US10730874, Compound I-247 | US11352356, Compound ...) Show SMILES Fc1c(Cl)ccn2cnc(CNC(=O)c3cn(Cc4cn5cc(cc(-n6cn[nH]c(=O)c6=O)c5n4)C4CC4)nn3)c12 Show InChI InChI=1S/C25H19ClFN11O3/c26-16-3-4-35-11-29-17(21(35)20(16)27)6-28-23(39)18-10-37(34-32-18)9-15-8-36-7-14(13-1-2-13)5-19(22(36)31-15)38-12-30-33-24(40)25(38)41/h3-5,7-8,10-13H,1-2,6,9H2,(H,28,39)(H,33,40)	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)
					More data for this Ligand-Target Pair