BDBM50332580 5-fluoro-3-(2-(pyrrolidin-1-yl)ethyl)-1H-indole::CHEMBL1630731
SMILES: Fc1ccc2[nH]cc(CCN3CCCC3)c2c1
InChI Key: InChIKey=ORCITSDDHKMOSI-UHFFFAOYSA-N
Data: 2 IC50
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Myeloperoxidase (MPO) (Homo sapiens (Human)) | BDBM50332580![]() (5-fluoro-3-(2-(pyrrolidin-1-yl)ethyl)-1H-indole | ...) | PDB MMDB KEGG B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universite£? Libre de Bruxelles Curated by ChEMBL | Assay Description Inhibition of recombinant MPO mediated LDL oxidation using MPO/Cl-/H2O2 system | J Med Chem 53: 8747-59 (2010) Article DOI: 10.1021/jm1009988 BindingDB Entry DOI: 10.7270/Q24T6JNJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Myeloperoxidase (MPO) (Homo sapiens (Human)) | BDBM50332580![]() (5-fluoro-3-(2-(pyrrolidin-1-yl)ethyl)-1H-indole | ...) | PDB MMDB KEGG B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Universite£? Libre de Bruxelles Curated by ChEMBL | Assay Description Inhibition of recombinant MPO mediated taurine chlorination by microplate reader method | J Med Chem 53: 8747-59 (2010) Article DOI: 10.1021/jm1009988 BindingDB Entry DOI: 10.7270/Q24T6JNJ | |||||||||||
More data for this Ligand-Target Pair |