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SMILES: CC(C)(O)Cn1nnc2cc(c(F)c(C#N)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=XZFTUDMYCBPHQN-KAZGAHJFSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 456518   
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))		BDBM456518
PNG
(US10723742, Example 247)
Show SMILES CC(C)(O)Cn1nnc2cc(c(F)c(C#N)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/C31H27F2N7O2/c1-31(2,42)15-39-29-23(14-35)28(33)22(12-26(29)37-38-39)20-7-5-17(30(41)40-19-6-8-27(40)25(36)11-19)9-21(20)16-3-4-18(13-34)24(32)10-16/h3-5,7,9-10,12,19,25,27,42H,6,8,11,15,36H2,1-2H3/t19-,25+,27+/m1/s1
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US Patent
n/an/a 0.230n/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