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BDBM223173 4-(2-(Ethyl(m-tolyl)amino)-2-oxoethyl)-N-(trans-4-((2-hydroxyethyl)carbamoyl)cyclohexyl)-4Hthieno[3,2-b]pyrrole-5-carboxamide (35)

SMILES: CCN(C(=O)Cn1c(cc2sccc12)C(=O)NC1CCC(CC1)C(=O)NCCO)c1cccc(C)c1

InChI Key: InChIKey=KLOQZVGWIWTJFY-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 223173   
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
NanoLuc luciferase (Nluc)


(Oplophorus gracilirostris (Luminous shrimp))
BDBM223173
PNG
(4-(2-(Ethyl(m-tolyl)amino)-2-oxoethyl)-N-(trans-4-...)
Show SMILES CCN(C(=O)Cn1c(cc2sccc12)C(=O)NC1CCC(CC1)C(=O)NCCO)c1cccc(C)c1
Show InChI InChI=1S/C27H34N4O4S/c1-3-30(21-6-4-5-18(2)15-21)25(33)17-31-22-11-14-36-24(22)16-23(31)27(35)29-20-9-7-19(8-10-20)26(34)28-12-13-32/h4-6,11,14-16,19-20,32H,3,7-10,12-13,17H2,1-2H3,(H,28,34)(H,29,35)
PDB

UniProtKB/SwissProt

GoogleScholar
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 830n/an/an/an/an/an/a



Promega Biosciences LLC



Assay Description
NanoLuc enzyme was diluted to 0.4 ng/mL in CO2 independent media + 10% FBS to make the detection reagent. A 3 dilution series of each inhibitor was ...


ACS Chem Biol 12: 1028-1037 (2017)


Article DOI: 10.1021/acschembio.6b01129
BindingDB Entry DOI: 10.7270/Q2SF2V1S
More data for this
Ligand-Target Pair