Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Lysine-specific histone demethylase 1A' and Ligand = 'BDBM456541'   

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
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456541 (US10723742, Example 270 | US10723742, Example 276 ...) Show SMILES Cc1c(F)c(cc2nnn(CC3(O)CCC3)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:40:39:37.36:34| Show InChI InChI=1S/C32H30F2N6O2/c1-17-29(34)24(14-27-30(17)39(38-37-27)16-32(42)9-2-10-32)22-7-5-19(31(41)40-21-6-8-28(40)26(36)13-21)11-23(22)18-3-4-20(15-35)25(33)12-18/h3-5,7,11-12,14,21,26,28,42H,2,6,8-10,13,16,36H2,1H3/t21-,26+,28+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.150	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The conditions for measuring inhibitory activity of compounds against LSD1 activity were determined with reference to a document available from the w...				Citation and Details BindingDB Entry DOI: 10.7270/Q2NC6513
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456541 (US10723742, Example 270 | US10723742, Example 276 ...) Show SMILES Cc1c(F)c(cc2nnn(CC3(O)CCC3)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:40:39:37.36:34| Show InChI InChI=1S/C32H30F2N6O2/c1-17-29(34)24(14-27-30(17)39(38-37-27)16-32(42)9-2-10-32)22-7-5-19(31(41)40-21-6-8-28(40)26(36)13-21)11-23(22)18-3-4-20(15-35)25(33)12-18/h3-5,7,11-12,14,21,26,28,42H,2,6,8-10,13,16,36H2,1H3/t21-,26+,28+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.150	n/a	n/a	n/a	n/a	n/a	n/a
Taiho Pharmaceutical Co., Ltd. US Patent					Assay Description The conditions for measuring inhibitory activity of compounds against LSD1 activity were determined with reference to a document available from the w...				US Patent US10723742 (2020) BindingDB Entry DOI: 10.7270/Q2TF01DB
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456541 (US10723742, Example 270 | US10723742, Example 276 ...) Show SMILES Cc1c(F)c(cc2nnn(CC3(O)CCC3)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:40:39:37.36:34| Show InChI InChI=1S/C32H30F2N6O2/c1-17-29(34)24(14-27-30(17)39(38-37-27)16-32(42)9-2-10-32)22-7-5-19(31(41)40-21-6-8-28(40)26(36)13-21)11-23(22)18-3-4-20(15-35)25(33)12-18/h3-5,7,11-12,14,21,26,28,42H,2,6,8-10,13,16,36H2,1H3/t21-,26+,28+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.390	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The conditions for measuring inhibitory activity of compounds against LSD1 activity were determined with reference to a document available from the w...				Citation and Details BindingDB Entry DOI: 10.7270/Q2NC6513
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456541 (US10723742, Example 270 | US10723742, Example 276 ...) Show SMILES Cc1c(F)c(cc2nnn(CC3(O)CCC3)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:40:39:37.36:34| Show InChI InChI=1S/C32H30F2N6O2/c1-17-29(34)24(14-27-30(17)39(38-37-27)16-32(42)9-2-10-32)22-7-5-19(31(41)40-21-6-8-28(40)26(36)13-21)11-23(22)18-3-4-20(15-35)25(33)12-18/h3-5,7,11-12,14,21,26,28,42H,2,6,8-10,13,16,36H2,1H3/t21-,26+,28+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.390	n/a	n/a	n/a	n/a	n/a	n/a
Taiho Pharmaceutical Co., Ltd. US Patent					Assay Description The conditions for measuring inhibitory activity of compounds against LSD1 activity were determined with reference to a document available from the w...				US Patent US10723742 (2020) BindingDB Entry DOI: 10.7270/Q2TF01DB
					More data for this Ligand-Target Pair