null
SMILES: Cc1cccc(c1)C12SCCN1C(=O)c1ccccc21
InChI Key: InChIKey=FQVDJZWFSZSGGA-UHFFFAOYSA-N
PDB links: 1 PDB ID matches this monomer.
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1) | BDBM1368 (9b-(3-methylphenyl)-2H,3H,5H,9bH-isoindolo[1,2-b][...) | PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid PDB UniChem Patents Similars | PDB PubMed | n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Mannheim GmbH Curated by ChEMBL | Assay Description In vitro for inhibitory activity against HIV-1 Reverse Transcriptase | J Med Chem 36: 726-32 (1993) BindingDB Entry DOI: 10.7270/Q2ZG6R9J | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Gag-Pol polyprotein [588-1027]/[588-1147] (Human immunodeficiency virus type 1) | BDBM1368 (9b-(3-methylphenyl)-2H,3H,5H,9bH-isoindolo[1,2-b][...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | n/a | n/a | 35 | n/a | n/a | n/a | n/a | 7.7 | 37 |
Boehringer Mannheim GmbH | Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro. | J Med Chem 36: 2526-35 (1993) Article DOI: 10.1021/jm00069a011 BindingDB Entry DOI: 10.7270/Q2BR8QCZ | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |