BDBM461315 US10774068, Example 20

SMILES: CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ncccc4C)cc3)c2cc1NC(=O)CCCN(C)C

InChI Key: InChIKey=SNORLBVOJNHDLQ-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 = 461315   

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
Serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM461315 (US10774068, Example 20) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ncccc4C)cc3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H34N6O3/c1-5-39-29-17-26-25(16-27(29)36-30(38)9-7-15-37(3)4)31(22(18-32)19-34-26)35-23-10-12-24(13-11-23)40-20-28-21(2)8-6-14-33-28/h6,8,10-14,16-17,19H,5,7,9,15,20H2,1-4H3,(H,34,35)(H,36,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020)
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461315 (US10774068, Example 20) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ncccc4C)cc3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H34N6O3/c1-5-39-29-17-26-25(16-27(29)36-30(38)9-7-15-37(3)4)31(22(18-32)19-34-26)35-23-10-12-24(13-11-23)40-20-28-21(2)8-6-14-33-28/h6,8,10-14,16-17,19H,5,7,9,15,20H2,1-4H3,(H,34,35)(H,36,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020)
					More data for this Ligand-Target Pair