BDBM12590 (6-aminoacridin-3-yl)amine::MLS003876812::Proflavin::Proflavine::SMR002533346::acridine-3,6-diamine::cid_7099

SMILES Nc1ccc2cc3ccc(N)cc3nc2c1

InChI Key InChIKey=WDVSHHCDHLJJJR-UHFFFAOYSA-N

Data  7 IC50  1 Kd  1 EC50

PDB links: 11 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 12590   

TargetReplicase polyprotein 1ab(2019-nCoV)
The State University Of New Jersey

Curated by ChEMBL
LigandPNGBDBM12590((6-aminoacridin-3-yl)amine | MLS003876812 | Profla...)
Affinity DataIC50:  1.46E+3nMAssay Description:Inhibition of SARS-CoV-2 papain-like protease using ISG15-AMC as substrateMore data for this Ligand-Target Pair
TargetReplicase polyprotein 1ab(2019-nCoV)
The State University Of New Jersey

Curated by ChEMBL
LigandPNGBDBM12590((6-aminoacridin-3-yl)amine | MLS003876812 | Profla...)
Affinity DataIC50:  830nMAssay Description:Primary assay principle based on quenched FRET peptide substrate of SARS-CoV-2 3CL-Pro (lhs). Inhibiting compounds reduce fluorescence signal relativ...More data for this Ligand-Target Pair
TargetReplicase polyprotein 1ab(2019-nCoV)
The State University Of New Jersey

Curated by ChEMBL
LigandPNGBDBM12590((6-aminoacridin-3-yl)amine | MLS003876812 | Profla...)
Affinity DataIC50:  1.66E+3nMAssay Description:Inhibition of SARS-CoV-2 papain-like protease using RLRGG-AMC as substrateMore data for this Ligand-Target Pair