BDBM50103523 CHEBI:6827::METHICILLIN::Methicillin::Meticillin::Staphcillin

SMILES: [H][C@@]1(NC(=O)c2c(OC)cccc2OC)C(=O)N2[C@@H](C(O)=O)C(C)(C)S[C@]12[H]

InChI Key: InChIKey=RJQXTJLFIWVMTO-TYNCELHUSA-N

Data: 2 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 2 hits for monomerid = 50103523   

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
Cytochrome P450 11A1 (Rattus norvegicus)	BDBM50103523 (CHEBI:6827 | METHICILLIN | Methicillin | Meticilli...) Show SMILES [H][C@@]1(NC(=O)c2c(OC)cccc2OC)C(=O)N2[C@@H](C(O)=O)C(C)(C)S[C@]12[H] Show InChI InChI=1S/C17H20N2O6S/c1-17(2)12(16(22)23)19-14(21)11(15(19)26-17)18-13(20)10-8(24-3)6-5-7-9(10)25-4/h5-7,11-12,15H,1-4H3,(H,18,20)(H,22,23)/t11-,12+,15-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	3.68E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lucigen Corporation Curated by ChEMBL					Assay Description Antibacterial activity against Enterococcus faecalis ATCC 51299 assessed as growth inhibition using fresh sample in DMSO by CLSI method				J Nat Prod 78: 924-8 (2015) Article DOI: 10.1021/np500911k BindingDB Entry DOI: 10.7270/Q2GT5R6X
					More data for this Ligand-Target Pair
Solute carrier family 22 member 8 (Mus musculus)	BDBM50103523 (CHEBI:6827 | METHICILLIN | Methicillin | Meticilli...) Show SMILES [H][C@@]1(NC(=O)c2c(OC)cccc2OC)C(=O)N2[C@@H](C(O)=O)C(C)(C)S[C@]12[H] Show InChI InChI=1S/C17H20N2O6S/c1-17(2)12(16(22)23)19-14(21)11(15(19)26-17)18-13(20)10-8(24-3)6-5-7-9(10)25-4/h5-7,11-12,15H,1-4H3,(H,18,20)(H,22,23)/t11-,12+,15-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.16E+5	n/a	n/a	n/a	n/a	n/a	n/a
Wilkes University Curated by ChEMBL					Assay Description Inhibition of mouse OAT3 expressed in CHO cells assessed as inhibition of fluorescein uptake over 20 mins				Drug Metab Dispos 41: 791-800 (2013) Article DOI: 10.1124/dmd.112.049569 BindingDB Entry DOI: 10.7270/Q2TF003W
					More data for this Ligand-Target Pair