Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Receptor tyrosine-protein kinase erbB-2' and Ligand = 'BDBM376987'   

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
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM376987 (US10329300, Example 75 | US11696917, Example 75 | ...) Show SMILES Cc1cc(NC(=O)N2CCCC2)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12 Show InChI InChI=1S/C26H31N9O3/c1-3-20(36)34-12-6-7-18(14-34)35-24-21(23(27)28-15-29-24)22(32-35)25(37)31-19-9-8-17(13-16(19)2)30-26(38)33-10-4-5-11-33/h3,8-9,13,15,18H,1,4-7,10-12,14H2,2H3,(H,30,38)(H,31,37)(H2,27,28,29)/t18-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2F193VV
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM376987 (US10329300, Example 75 | US11696917, Example 75 | ...) Show SMILES Cc1cc(NC(=O)N2CCCC2)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12 Show InChI InChI=1S/C26H31N9O3/c1-3-20(36)34-12-6-7-18(14-34)35-24-21(23(27)28-15-29-24)22(32-35)25(37)31-19-9-8-17(13-16(19)2)30-26(38)33-10-4-5-11-33/h3,8-9,13,15,18H,1,4-7,10-12,14H2,2H3,(H,30,38)(H,31,37)(H2,27,28,29)/t18-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
TAIHO PHARMACEUTICAL CO., LTD. US Patent					Assay Description For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...				US Patent US10329300 (2019) BindingDB Entry DOI: 10.7270/Q2MG7RWF
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM376987 (US10329300, Example 75 | US11696917, Example 75 | ...) Show SMILES Cc1cc(NC(=O)N2CCCC2)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12 Show InChI InChI=1S/C26H31N9O3/c1-3-20(36)34-12-6-7-18(14-34)35-24-21(23(27)28-15-29-24)22(32-35)25(37)31-19-9-8-17(13-16(19)2)30-26(38)33-10-4-5-11-33/h3,8-9,13,15,18H,1,4-7,10-12,14H2,2H3,(H,30,38)(H,31,37)(H2,27,28,29)/t18-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Universite Paris 7-Denis Diderot					Assay Description For the inhibitory activity measurement of each compound, the compound of the present invention or staurosporine was first serially diluted with dime...				Bioorg Med Chem 16: 1242-53 (2008) BindingDB Entry DOI: 10.7270/Q2BR8VHD
					More data for this Ligand-Target Pair