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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin-1' and Ligand = 'BDBM173092'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Endothelin-1


(Homo sapiens (Human))
BDBM173092
PNG
(US9675593, 706)
Show SMILES CCOc1ccc(CNc2cc(=O)n(cc2-c2cnn(C)c2)-c2ccc(OCC)cc2C)c(C)c1
Show InChI InChI=1S/C28H32N4O3/c1-6-34-23-9-8-21(19(3)12-23)15-29-26-14-28(33)32(18-25(26)22-16-30-31(5)17-22)27-11-10-24(35-7-2)13-20(27)4/h8-14,16-18,29H,6-7,15H2,1-5H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
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