null

SMILES: CCn1cc(C)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12

InChI Key: InChIKey=FMRRDKHCBMCCHR-FQEVSTJZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 128402   

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
Mitogen-activated protein kinase kinase kinase 5 (Homo sapiens (Human))	BDBM128402 (US8802695, 18) Show SMILES CCn1cc(C)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r| Show InChI InChI=1S/C20H23N3O3/c1-4-23-11-13(2)16-10-21-18(9-17(16)23)22-19(25)14-5-7-15(8-6-14)20(3,26)12-24/h5-11,24,26H,4,12H2,1-3H3,(H,21,22,25)/t20-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	7.3	25
Takeda Pharmaceutical Company Limited US Patent					Assay Description The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...				US Patent US8802695 (2014) BindingDB Entry DOI: 10.7270/Q27W69WD
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5 (Homo sapiens (Human))	BDBM128402 (US8802695, 18) Show SMILES CCn1cc(C)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r| Show InChI InChI=1S/C20H23N3O3/c1-4-23-11-13(2)16-10-21-18(9-17(16)23)22-19(25)14-5-7-15(8-6-14)20(3,26)12-24/h5-11,24,26H,4,12H2,1-3H3,(H,21,22,25)/t20-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	7.5	25
Takeda Pharmaceutical Company Limited US Patent					Assay Description The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...				US Patent US8802695 (2014) BindingDB Entry DOI: 10.7270/Q27W69WD
					More data for this Ligand-Target Pair