BDBM456528 US10723742, Example 257::US10723742, Example 269

SMILES: N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2cc3nnn(CC4(O)CCC4)c3c(Cl)c2F)c(c1)-c1ccc(C#N)c(F)c1

InChI Key: InChIKey=JDCBYCFXSSLZST-LUPFDQBXSA-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 = 456528   

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
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456528 (US10723742, Example 257 | US10723742, Example 269) Show SMILES N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2cc3nnn(CC4(O)CCC4)c3c(Cl)c2F)c(c1)-c1ccc(C#N)c(F)c1 |THB:0:1:5.4:7| Show InChI InChI=1S/C31H27ClF2N6O2/c32-27-28(34)22(13-25-29(27)39(38-37-25)15-31(42)8-1-9-31)20-6-4-17(30(41)40-19-5-7-26(40)24(36)12-19)10-21(20)16-2-3-18(14-35)23(33)11-16/h2-4,6,10-11,13,19,24,26,42H,1,5,7-9,12,15,36H2/t19-,24+,26+/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	0.410	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)
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456528 (US10723742, Example 257 | US10723742, Example 269) Show SMILES N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2cc3nnn(CC4(O)CCC4)c3c(Cl)c2F)c(c1)-c1ccc(C#N)c(F)c1 |THB:0:1:5.4:7| Show InChI InChI=1S/C31H27ClF2N6O2/c32-27-28(34)22(13-25-29(27)39(38-37-25)15-31(42)8-1-9-31)20-6-4-17(30(41)40-19-5-7-26(40)24(36)12-19)10-21(20)16-2-3-18(14-35)23(33)11-16/h2-4,6,10-11,13,19,24,26,42H,1,5,7-9,12,15,36H2/t19-,24+,26+/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	0.120	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)
					More data for this Ligand-Target Pair