BDBM50440390 ISOMETAMIDIUM

SMILES: CCn1c(-c2ccccc2)c2cc(NN=Nc3cccc(c3)C(N)=N)ccc2c2ccc(=[NH2+])cc12

InChI Key: InChIKey=WXXPWRQRSAACNT-UHFFFAOYSA-O

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 = 50440390   

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
Telomerase reverse transcriptase (Homo sapiens (Human))	BDBM50440390 (ISOMETAMIDIUM) Show SMILES CCn1c(-c2ccccc2)c2cc(NN=Nc3cccc(c3)C(N)=N)ccc2c2ccc(=[NH2+])cc12 |w:15.16| Show InChI InChI=1S/C28H25N7/c1-2-35-26-16-20(29)11-13-24(26)23-14-12-22(17-25(23)27(35)18-7-4-3-5-8-18)33-34-32-21-10-6-9-19(15-21)28(30)31/h3-17,29H,2H2,1H3,(H3,30,31)(H,32,33)/p+1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	1.91E+7	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of telomerase in Homo sapiens (human) HeLa cells after 30 min by TRAP assay				Citation and Details Article DOI: 10.1007/s00044-011-9594-4 BindingDB Entry DOI: 10.7270/Q2X63QV3
					More data for this Ligand-Target Pair
Telomerase reverse transcriptase (Homo sapiens (Human))	BDBM50440390 (ISOMETAMIDIUM) Show SMILES CCn1c(-c2ccccc2)c2cc(NN=Nc3cccc(c3)C(N)=N)ccc2c2ccc(=[NH2+])cc12 |w:15.16| Show InChI InChI=1S/C28H25N7/c1-2-35-26-16-20(29)11-13-24(26)23-14-12-22(17-25(23)27(35)18-7-4-3-5-8-18)33-34-32-21-10-6-9-19(15-21)28(30)31/h3-17,29H,2H2,1H3,(H3,30,31)(H,32,33)/p+1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi"Magna Gr£cia" Curated by ChEMBL					Assay Description Inhibition of telomerase (unknown origin) by TRAP assay				Eur J Med Chem 68: 139-49 (2013) Article DOI: 10.1016/j.ejmech.2013.07.022 BindingDB Entry DOI: 10.7270/Q24J0GJB
					More data for this Ligand-Target Pair