BDBM301630 US10131675, Example 116

SMILES: CC1(C)OCCn2c1nc1c(nc(cc21)-c1cnc(N)nc1)N1CC2CC1C2

InChI Key: InChIKey=VRLNLBINPVTODP-UHFFFAOYSA-N

Data: 1 KI

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 1 hit for monomerid = 301630   

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 12 (Homo sapiens (Human))	BDBM301630 (US10131675, Example 116) Show SMILES CC1(C)OCCn2c1nc1c(nc(cc21)-c1cnc(N)nc1)N1CC2CC1C2 |(-4.81,.53,;-5.21,-.96,;-6.7,-.56,;-5.83,-2.37,;-4.93,-3.61,;-3.4,-3.45,;-2.77,-2.05,;-3.68,-.8,;-2.77,.45,;-1.31,-.03,;.03,.74,;1.36,-.03,;1.36,-1.57,;.03,-2.34,;-1.31,-1.57,;2.69,-2.34,;2.69,-3.88,;4.03,-4.65,;5.36,-3.88,;6.7,-4.65,;5.36,-2.34,;4.03,-1.57,;.03,2.28,;-1.22,3.19,;-.74,4.65,;.8,4.65,;1.27,3.19,;.03,3.32,)| Show InChI InChI=1S/C20H23N7O/c1-20(2)18-25-16-15(26(18)3-4-28-20)7-14(12-8-22-19(21)23-9-12)24-17(16)27-10-11-5-13(27)6-11/h7-9,11,13H,3-6,10H2,1-2H3,(H2,21,22,23)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	21.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. US Patent					Assay Description DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...				US Patent US10131675 (2018) BindingDB Entry DOI: 10.7270/Q21G0P92
					More data for this Ligand-Target Pair