BDBM395077 US10308615, Example 88::{6-[(4- methoxybenzyl) amino]pyridazin-3- yl}[3- (trifluoromethyl) phenyl]methanone

SMILES: COc1ccc(CNc2ccc(nn2)C(=O)c2cccc(c2)C(F)(F)F)cc1

InChI Key: InChIKey=XCAPUVSPAQRLOA-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 395077   

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
Pantetheinase (Homo sapiens (Human))	BDBM395077 (US10308615, Example 88 | {6-[(4- methoxybenzyl) am...) Show SMILES COc1ccc(CNc2ccc(nn2)C(=O)c2cccc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C20H16F3N3O2/c1-28-16-7-5-13(6-8-16)12-24-18-10-9-17(25-26-18)19(27)14-3-2-4-15(11-14)20(21,22)23/h2-11H,12H2,1H3,(H,24,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.30	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description The vanin-1 protein was prepared in-house from a construct expressing the extracellular domain of human vanin-1 (GenBank ID NM_004666) preceded N-ter...				Bioorg Med Chem Lett 19: 3664-8 (2009) BindingDB Entry DOI: 10.7270/Q22809Z8
					More data for this Ligand-Target Pair
Pantetheinase (Homo sapiens (Human))	BDBM395077 (US10308615, Example 88 | {6-[(4- methoxybenzyl) am...) Show SMILES COc1ccc(CNc2ccc(nn2)C(=O)c2cccc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C20H16F3N3O2/c1-28-16-7-5-13(6-8-16)12-24-18-10-9-17(25-26-18)19(27)14-3-2-4-15(11-14)20(21,22)23/h2-11H,12H2,1H3,(H,24,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.86E+4	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description The vanin-1 protein was prepared in-house from a construct expressing the extracellular domain of human vanin-1 (GenBank ID NM_004666) preceded N-ter...				Bioorg Med Chem Lett 19: 3664-8 (2009) BindingDB Entry DOI: 10.7270/Q22809Z8
					More data for this Ligand-Target Pair