BindingDB logo
myBDB logout

null

SMILES: [Br-].FC(F)(F)c1ccc(C[n+]2ccc3ccnc4-c5ccccc5-c2c34)cc1

InChI Key: InChIKey=LSBYIJLUGAHPDW-UHFFFAOYSA-N

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 = 50202895   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
DNA topoisomerase 1


(Homo sapiens (Human))		BDBM50202895
PNG
(CHEMBL3976611)
Show SMILES [Br-].FC(F)(F)c1ccc(C[n+]2ccc3ccnc4-c5ccccc5-c2c34)cc1
Show InChI InChI=1S/C22H14F3N2/c23-22(24,25)16-7-5-14(6-8-16)13-27-12-10-15-9-11-26-20-17-3-1-2-4-18(17)21(27)19(15)20/h1-12H,13H2/q+1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 6.99E+4n/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human DNA topoisomerase 1 using pHOT1 as substrate after 30 mins by agarose gel electrophoresis

Bioorg Med Chem 24: 6119-6130 (2016)


Article DOI: 10.1016/j.bmc.2016.02.028
BindingDB Entry DOI: 10.7270/Q2BG2QZJ
More data for this
Ligand-Target Pair