BDBM2465 10-methyi-5H- pyrrolo1,2 -b] [ 1,2,5] benzothiadiazepin- 11(10H)-one-5,5-dioxide::9-methyl-2-thia-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(10),4,6,11,13-pentaene-2,2,8-trione::Pyrrolobenzothiadiazepine (PBTD) 10b

SMILES: CN1c2ccccc2S(=O)(=O)n2cccc2C1=O

InChI Key: InChIKey=YFWBVALDBYKUBG-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 2465   

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 (Human immunodeficiency virus 1)	BDBM2465 (10-methyi-5H- pyrrolo1,2 -b] [ 1,2,5] benzothiadia...) Show SMILES CN1c2ccccc2S(=O)(=O)n2cccc2C1=O Show InChI InChI=1S/C12H10N2O3S/c1-13-9-5-2-3-7-11(9)18(16,17)14-8-4-6-10(14)12(13)15/h2-8H,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Experimental Botany ASCR & Palack£ University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				Bioorg Med Chem 23: 5247-63 (2015) Article DOI: 10.1016/j.bmc.2015.06.016 BindingDB Entry DOI: 10.7270/Q20P131K
					More data for this Ligand-Target Pair
HIV-1 Reverse Transcriptase (Human immunodeficiency virus type 1)	BDBM2465 (10-methyi-5H- pyrrolo1,2 -b] [ 1,2,5] benzothiadia...) Show SMILES CN1c2ccccc2S(=O)(=O)n2cccc2C1=O Show InChI InChI=1S/C12H10N2O3S/c1-13-9-5-2-3-7-11(9)18(16,17)14-8-4-6-10(14)12(13)15/h2-8H,1H3	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	7.8	37
Universita di Roma La Sapienza					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.				Bioorg Med Chem 4: 837-50 (1996) Article DOI: 10.1016/0968-0896(96)00075-2 BindingDB Entry DOI: 10.7270/Q2GF0RQZ
					More data for this Ligand-Target Pair