BDBM333388 3-[(1R)-1-Hydroxy-2- {[3-(4-methoxy-1- benzofuran-2- yl)imidazo[1,2-b]pyridazin- 6-yl](methyl)amino}eth- yl]phenol::US9730929, Example 9

SMILES: COc1cccc2oc(cc12)-c1cnc2ccc(nn12)N(C)C[C@H](O)c1cccc(O)c1

InChI Key: InChIKey=KJGPWXPBUDJVTJ-IBGZPJMESA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 333388   

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
MAP kinase-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM333388 (3-[(1R)-1-Hydroxy-2- {[3-(4-methoxy-1- benzofuran-...) Show SMILES COc1cccc2oc(cc12)-c1cnc2ccc(nn12)N(C)C[C@H](O)c1cccc(O)c1 |r| Show InChI InChI=1S/C24H22N4O4/c1-27(14-19(30)15-5-3-6-16(29)11-15)24-10-9-23-25-13-18(28(23)26-24)22-12-17-20(31-2)7-4-8-21(17)32-22/h3-13,19,29-30H,14H2,1-2H3/t19-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
BAYER INTELLECTUAL PROPERTY GMBH US Patent					Assay Description A recombinant fusion protein of Glutathione-S-Transferase (GST, N-terminally) and human full-length MKNK1 (amino acids 1-424 and T344D of accession n...				US Patent US9730929 (2017) BindingDB Entry DOI: 10.7270/Q28S4S1H
					More data for this Ligand-Target Pair