BDBM95801 (12aS)-2-methyl-6-(3-nitrophenyl)-6,7,12,12a-tetrahydro-3H-pyrazino[1,2-b]-carboline-1,4-quinone::MLS001164854::SMR000540129::cid_16398776

SMILES: CN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)C2c2cccc(c2)[N+]([O-])=O)C1=O

InChI Key: InChIKey=ZNANMCXUAVZKKP-DIMJTDRSSA-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 = 95801   

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
methionyl-tRNA synthetase (Trypanosoma brucei brucei strain 927/4 GUTat10.1)	BDBM95801 ((12aS)-2-methyl-6-(3-nitrophenyl)-6,7,12,12a-tetra...) Show SMILES CN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)C2c2cccc(c2)[N+]([O-])=O)C1=O Show InChI InChI=1S/C21H18N4O4/c1-23-11-18(26)24-17(21(23)27)10-15-14-7-2-3-8-16(14)22-19(15)20(24)12-5-4-6-13(9-12)25(28)29/h2-9,17,20,22H,10-11H2,1H3/t17-,20?/m0/s1	PDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	393	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q2XP73JZ
					More data for this Ligand-Target Pair