BDBM50293603 (2S,3R,4S,4aR)-2,3,4,7-Tetrahydroxy-3,4,4a,5-tetrahydro-2H-[1,3]dioxolo[4,5-j]phenanthridin-6-one::CHEMBL98745::NARCICLASINE::cid_619061

SMILES: c1c2c(c(c3c1OCO3)O)C(=O)N[C@@H]4C2=C[C@@H]([C@H]([C@H]4O)O)O

InChI Key: InChIKey=LZAZURSABQIKGB-UHFFFAOYSA-N

Data: 2 KI  3 IC50

PDB links: 1 PDB ID matches this monomer.

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 5 hits for monomerid = 50293603   

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
Beta-lactamase (Pseudomonas aeruginosa)	BDBM50293603 ((2S,3R,4S,4aR)-2,3,4,7-Tetrahydroxy-3,4,4a,5-tetra...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.97E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 2 (Human)	BDBM50293603 ((2S,3R,4S,4aR)-2,3,4,7-Tetrahydroxy-3,4,4a,5-tetra...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.97E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Protein skinhead-1 (Caenorhabditis elegans)	BDBM50293603 ((2S,3R,4S,4aR)-2,3,4,7-Tetrahydroxy-3,4,4a,5-tetra...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM50293603 ((2S,3R,4S,4aR)-2,3,4,7-Tetrahydroxy-3,4,4a,5-tetra...) Show SMILES Show InChI	GoogleScholar	UniChem		630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM50293603 ((2S,3R,4S,4aR)-2,3,4,7-Tetrahydroxy-3,4,4a,5-tetra...) Show SMILES Show InChI	GoogleScholar	UniChem		630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair