BDBM50180307 8-(6-iodo-benzo[1,3]dioxol-5-ylsulfanyl)-9-(pent-4-ynyl)adenine::CHEMBL372962

SMILES: Nc1ncnc2n(CCCC#C)c(Sc3cc4OCOc4cc3I)nc12

InChI Key: InChIKey=QSNAITKZUCGADX-UHFFFAOYSA-N

Data: 1 IC50  2 EC50

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 3 hits for monomerid = 50180307   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Heat shock protein HSP 90-beta (Human)	BDBM50180307 (8-(6-iodo-benzo[1,3]dioxol-5-ylsulfanyl)-9-(pent-4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-beta (Human)	BDBM50180307 (8-(6-iodo-benzo[1,3]dioxol-5-ylsulfanyl)-9-(pent-4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	10.9	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-beta (Human)	BDBM50180307 (8-(6-iodo-benzo[1,3]dioxol-5-ylsulfanyl)-9-(pent-4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	10.8	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair