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  8 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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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 12590   

TargetProthrombin(Human)
Astex

LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
Affinity DataIC50: 1.20E+4nMpH: 8.0 T: 2°CAssay Description:The cleavage of the substrate was followed by monitoring the change in fluorescence at 460 nm (excitation at 365 nm) for 25 min at room temperature o...More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetPC4 and SFRS1-interacting protein(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
Affinity DataIC50: 4.34E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: Ohio State University Assay Provider: Mam...More data for this Ligand-Target Pair
In DepthDetails
PCBioAssay
TargetPC4 and SFRS1-interacting protein(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
Affinity DataIC50: 4.46E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: Ohio State University Assay Provider: Mam...More data for this Ligand-Target Pair
In DepthDetails
PCBioAssay
TargetCystic fibrosis transmembrane conductance regulator(Human)
Southern Research Institute

Curated by PubChem BioAssay
LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
Affinity DataIC50: 8.88E+3nMMore data for this Ligand-Target Pair
In DepthDetails
PCBioAssay
TargetCystic fibrosis transmembrane conductance regulator(Human)
Southern Research Institute

Curated by PubChem BioAssay
LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
Affinity DataEC50: >5.00E+4nMMore data for this Ligand-Target Pair
In DepthDetails
PCBioAssay
TargetMajor pollen allergen Bet v 1-A(European white birch)
University of Innsbruck

Curated by ChEMBL
LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
Affinity DataKd:  1.40E+5nMAssay Description:Binding affinity to birch major pollen allergen Bet v 1-A assessed as binding constant at 1H-6 resonance by (1)H relaxation dispersion NMR spectrosco...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Fraunhofer Institute For Translational Medicine and Pharmacology (Itmp) and Fraunhofer Cluster of Excellence For Immune Mediated Diseases (Cimd

LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
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
In DepthDetails Article

TargetReplicase polyprotein 1ab(2019-nCoV)
Fraunhofer Institute For Translational Medicine and Pharmacology (Itmp) and Fraunhofer Cluster of Excellence For Immune Mediated Diseases (Cimd

LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
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
In DepthDetails Article
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Fraunhofer Institute For Translational Medicine and Pharmacology (Itmp) and Fraunhofer Cluster of Excellence For Immune Mediated Diseases (Cimd

LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
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
In DepthDetails Article
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Fraunhofer Institute For Translational Medicine and Pharmacology (Itmp) and Fraunhofer Cluster of Excellence For Immune Mediated Diseases (Cimd

LigandPNGBDBM12590(acridine-3,6-diamine | (6-aminoacridin-3-yl)amine ...)
Affinity DataIC50: 2.07E+3nMAssay Description:Inhibition of C-terminal GST-tagged SARS-CoV-2 Main protease by using MCA-AVLQSGFR(Dnp)-Lys-NH2 as fluorogenic substrate incubated for 15 mins follow...More data for this Ligand-Target Pair
In DepthDetails
PubMed