BDBM158770 US9034866, 245

SMILES: C[C@@H]1Cn2cc(nc2-c2cc(ccc2O1)C#CC(C)(C)O)C(N)=O

InChI Key: InChIKey=FCLUEVDLZSWFCZ-LLVKDONJSA-N

Data: 4 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 4 hits for monomerid = 158770   

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 14 (Homo sapiens (Human))	BDBM158770 (US9034866, 245) Show SMILES C[C@@H]1Cn2cc(nc2-c2cc(ccc2O1)C#CC(C)(C)O)C(N)=O |r| Show InChI InChI=1S/C18H19N3O3/c1-11-9-21-10-14(16(19)22)20-17(21)13-8-12(4-5-15(13)24-11)6-7-18(2,3)23/h4-5,8,10-11,23H,9H2,1-3H3,(H2,19,22)/t11-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	620	n/a	n/a	n/a	n/a	n/a	n/a	7.2	n/a
Genentech, Inc. US Patent					Assay Description The ability of the nuclear factor-kappa B (NF-kB)-inducing kinase (NIK) to catalyze the hydrolysis of adenosine-5'-triphosphate (ATP) was monitored u...				US Patent US9034866 (2015) BindingDB Entry DOI: 10.7270/Q2GX49B0
					More data for this Ligand-Target Pair
Phosphoinositide 3-Kinase (PI3K), delta (Homo sapiens (Human))	BDBM158770 (US9034866, 245) Show SMILES C[C@@H]1Cn2cc(nc2-c2cc(ccc2O1)C#CC(C)(C)O)C(N)=O |r| Show InChI InChI=1S/C18H19N3O3/c1-11-9-21-10-14(16(19)22)20-17(21)13-8-12(4-5-15(13)24-11)6-7-18(2,3)23/h4-5,8,10-11,23H,9H2,1-3H3,(H2,19,22)/t11-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of N-terminal His6-tagged recombinant full-length human p110delta/untagged recombinant full length human p85alpha expressed in baculovirus...				J Med Chem 60: 627-640 (2017) Article DOI: 10.1021/acs.jmedchem.6b01363 BindingDB Entry DOI: 10.7270/Q2K35X4S
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14 (Homo sapiens (Human))	BDBM158770 (US9034866, 245) Show SMILES C[C@@H]1Cn2cc(nc2-c2cc(ccc2O1)C#CC(C)(C)O)C(N)=O |r| Show InChI InChI=1S/C18H19N3O3/c1-11-9-21-10-14(16(19)22)20-17(21)13-8-12(4-5-15(13)24-11)6-7-18(2,3)23/h4-5,8,10-11,23H,9H2,1-3H3,(H2,19,22)/t11-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.2	n/a
Genentech, Inc. US Patent					Assay Description The ability of the nuclear factor-kappa B (NF-kB)-inducing kinase (NIK) to catalyze the hydrolysis of adenosine-5'-triphosphate (ATP) was monitored u...				US Patent US9034866 (2015) BindingDB Entry DOI: 10.7270/Q2GX49B0
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14 (Homo sapiens (Human))	BDBM158770 (US9034866, 245) Show SMILES C[C@@H]1Cn2cc(nc2-c2cc(ccc2O1)C#CC(C)(C)O)C(N)=O |r| Show InChI InChI=1S/C18H19N3O3/c1-11-9-21-10-14(16(19)22)20-17(21)13-8-12(4-5-15(13)24-11)6-7-18(2,3)23/h4-5,8,10-11,23H,9H2,1-3H3,(H2,19,22)/t11-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of NIK (unknown origin) after 1 to 2 hrs by ADP-FP assay				J Med Chem 60: 627-640 (2017) Article DOI: 10.1021/acs.jmedchem.6b01363 BindingDB Entry DOI: 10.7270/Q2K35X4S
					More data for this Ligand-Target Pair