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SMILES: Cc1c(cnn1C)-c1ccc(=O)n(c1)-c1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=WMKCKPMVSYGLJI-UHFFFAOYSA-N

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 1 hit for monomerid = 172317   
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
Endothelin-1


(Homo sapiens (Human))		BDBM172317
PNG
(US9675593, 391)
Show SMILES Cc1c(cnn1C)-c1ccc(=O)n(c1)-c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C17H14F3N3O2/c1-11-15(9-21-22(11)2)12-3-8-16(24)23(10-12)13-4-6-14(7-5-13)25-17(18,19)20/h3-10H,1-2H3
UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a<5.00E+4n/an/an/an/a



SRMLSC

US Patent


Assay Description
Fibroblasts (primary human lung and dermal, HFL-1, 3T3 etc) are seeded in 96-well plates at ~15000 cells/well and serum starved for 0-48 hours. After...

US Patent US9675593 (2017)


BindingDB Entry DOI: 10.7270/Q2319T24
More data for this
Ligand-Target Pair