BDBM1412 (9bR)-8-chloro-9b-phenyl-2H,3H,5H,9bH-isoindolo[1,2-b][1,3]thiazol-5-one::Thiazoloisoindol-5-one deriv. 53R

SMILES: Clc1ccc2C(=O)N3CCS[C@@]3(c2c1)c1ccccc1

InChI Key: InChIKey=RTNOCCMBORWWLT-MRXNPFEDSA-N

Data: 1 IC50

PDB links: 1 PDB ID contains inhibitors having a similarity of 90% to this monomer.

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 1412   

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
HIV-1 Reverse Transcriptase (Human immunodeficiency virus type 1)	BDBM1412 ((9bR)-8-chloro-9b-phenyl-2H,3H,5H,9bH-isoindolo[1,...) Show SMILES Clc1ccc2C(=O)N3CCS[C@@]3(c2c1)c1ccccc1 |r| Show InChI InChI=1S/C16H12ClNOS/c17-12-6-7-13-14(10-12)16(11-4-2-1-3-5-11)18(15(13)19)8-9-20-16/h1-7,10H,8-9H2/t16-/m1/s1	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
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