BDBM354884 Preparation of 3-phenyl-N-{4-[5-(3,4,5-trimethoxy-phenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-benzyl}-propionamide::US10485800, Example 161::US9814704, Example 161

SMILES: COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc(CNC(=O)CCc4ccccc4)cc3)c2c1

InChI Key: InChIKey=JBEFIYDFSGDPBQ-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 = 354884   

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 11 (Homo sapiens (Human))	BDBM354884 (Preparation of 3-phenyl-N-{4-[5-(3,4,5-trimethoxy-...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc(CNC(=O)CCc4ccccc4)cc3)c2c1 Show InChI InChI=1S/C32H31N3O4/c1-37-28-16-24(17-29(38-2)31(28)39-3)25-15-26-27(20-35-32(26)34-19-25)23-12-9-22(10-13-23)18-33-30(36)14-11-21-7-5-4-6-8-21/h4-10,12-13,15-17,19-20H,11,14,18H2,1-3H3,(H,33,36)(H,34,35)	PDB NCI pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL 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 University of Rochester; Board of Regents of the University of Nebraska US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US10485800 (2019) BindingDB Entry DOI: 10.7270/Q22B91DW
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354884 (Preparation of 3-phenyl-N-{4-[5-(3,4,5-trimethoxy-...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc(CNC(=O)CCc4ccccc4)cc3)c2c1 Show InChI InChI=1S/C32H31N3O4/c1-37-28-16-24(17-29(38-2)31(28)39-3)25-15-26-27(20-35-32(26)34-19-25)23-12-9-22(10-13-23)18-33-30(36)14-11-21-7-5-4-6-8-21/h4-10,12-13,15-17,19-20H,11,14,18H2,1-3H3,(H,33,36)(H,34,35)	PDB NCI pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL 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 University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair