Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein Wnt-3a' and Ligand = 'BDBM300603'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Protein Wnt-3a (Homo sapiens (Human))	BDBM300603 (4-chloro-3-{[(4-methylpiperazin-1-yl)acetyl]amino}...) Show SMILES CN1CCN(CC(=O)Nc2cc(ccc2Cl)C(=O)Nc2nnc(s2)-c2ccccc2)CC1 |$;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$| Show InChI InChI=1S/C22H23ClN6O2S/c1-28-9-11-29(12-10-28)14-19(30)24-18-13-16(7-8-17(18)23)20(31)25-22-27-26-21(32-22)15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3,(H,24,30)(H,25,27,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
BAYER PHARMA AKTIENGESELLSCHAFT US Patent					Assay Description In preparation of the assay, the two cell lines were plated 24 hours before at 10000 cells per well of a 384 micro titre plate (MTP) in 30 μL gr...				US Patent US10130633 (2018) BindingDB Entry DOI: 10.7270/Q2FN188G
					More data for this Ligand-Target Pair
Protein Wnt-3a (Homo sapiens (Human))	BDBM300603 (4-chloro-3-{[(4-methylpiperazin-1-yl)acetyl]amino}...) Show SMILES CN1CCN(CC(=O)Nc2cc(ccc2Cl)C(=O)Nc2nnc(s2)-c2ccccc2)CC1 |$;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$| Show InChI InChI=1S/C22H23ClN6O2S/c1-28-9-11-29(12-10-28)14-19(30)24-18-13-16(7-8-17(18)23)20(31)25-22-27-26-21(32-22)15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3,(H,24,30)(H,25,27,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
BAYER PHARMA AKTIENGESELLSCHAFT US Patent					Assay Description In preparation of the assay, the two cell lines were plated 24 hours before at 10000 cells per well of a 384 micro titre plate (MTP) in 30 μL gr...				US Patent US10130633 (2018) BindingDB Entry DOI: 10.7270/Q2FN188G
					More data for this Ligand-Target Pair