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SMILES: CC(C)(O)Cn1ncc2cc(c(F)c(F)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2

InChI Key: InChIKey=BKGNAUSBFVIPGI-BQQUOAEZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 456469   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))		BDBM456469
PNG
(US10723742, Example 195)
Show SMILES CC(C)(O)Cn1ncc2cc(c(F)c(F)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:39:38:36.35:33|
Show InChI InChI=1S/C31H28F3N5O2/c1-31(2,41)15-38-29-19(14-37-38)10-23(27(33)28(29)34)21-7-5-17(30(40)39-20-6-8-26(39)25(36)12-20)9-22(21)16-3-4-18(13-35)24(32)11-16/h3-5,7,9-11,14,20,25-26,41H,6,8,12,15,36H2,1-2H3/t20-,25+,26+/m1/s1
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US Patent
n/an/a 0.200n/an/an/an/an/an/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