BDBM50544293 CHEMBL4646290

SMILES: CCN(CC)CCCNc1c2CC\C(=C/c3ccc(cc3)C(C)C)c2nc2ccccc12

InChI Key: InChIKey=KCHICHDEOJGPNE-HIXSDJFHSA-N

Data: 1 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 1 hit for monomerid = 50544293   

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
Bloom syndrome protein (Homo sapiens (Human))	BDBM50544293 (CHEMBL4646290) Show SMILES CCN(CC)CCCNc1c2CC\C(=C/c3ccc(cc3)C(C)C)c2nc2ccccc12 Show InChI InChI=1S/C29H37N3/c1-5-32(6-2)19-9-18-30-29-25-10-7-8-11-27(25)31-28-24(16-17-26(28)29)20-22-12-14-23(15-13-22)21(3)4/h7-8,10-15,20-21H,5-6,9,16-19H2,1-4H3,(H,30,31)/b24-20+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	8.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of His-tagged BLM (642 to 1296 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) cells assessed as reduction in DNA unwi...				J Med Chem 63: 9752-9772 (2020)
					More data for this Ligand-Target Pair