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BDBM50512786 CHEMBL4460889

SMILES: CC(=O)NC[C@H]1CN(C(=O)O1)c1ccc(N2CCO[C@@]3(CCCOC3)C2)c(F)c1

InChI Key: InChIKey=NRWYXTJNSKOQIE-JXFKEZNVSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50512786   
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
Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial


(Homo sapiens)
BDBM50512786
PNG
(CHEMBL4460889)
Show SMILES CC(=O)NC[C@H]1CN(C(=O)O1)c1ccc(N2CCO[C@@]3(CCCOC3)C2)c(F)c1 |r|
Show InChI InChI=1S/C20H26FN3O5/c1-14(25)22-10-16-11-24(19(26)29-16)15-3-4-18(17(21)9-15)23-6-8-28-20(12-23)5-2-7-27-13-20/h3-4,9,16H,2,5-8,10-13H2,1H3,(H,22,25)/t16-,20-/m0/s1
PDB

Reactome pathway

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UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



California Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of SDH-A (unknown origin) by ELISA


Bioorg Med Chem Lett 29: 2686-2689 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.024
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM50512786
PNG
(CHEMBL4460889)
Show SMILES CC(=O)NC[C@H]1CN(C(=O)O1)c1ccc(N2CCO[C@@]3(CCCOC3)C2)c(F)c1 |r|
Show InChI InChI=1S/C20H26FN3O5/c1-14(25)22-10-16-11-24(19(26)29-16)15-3-4-18(17(21)9-15)23-6-8-28-20(12-23)5-2-7-27-13-20/h3-4,9,16H,2,5-8,10-13H2,1H3,(H,22,25)/t16-,20-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



California Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of COX1 (unknown origin) by ELISA


Bioorg Med Chem Lett 29: 2686-2689 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.024
More data for this
Ligand-Target Pair