BDBM50441139 ARYLOMYCIN C16
SMILES: CCCCCCCCCCCCCCCC(=O)N(C)[C@H](CO)C(=O)N[C@H](C)C(=O)NCC(=O)N(C)[C@H]1c2ccc(O)c(c2)-c2cc(C[C@H](NC(=O)[C@H](C)NC1=O)C(O)=O)ccc2O
InChI Key: InChIKey=HGWCKYGOWQEYSJ-JBWZRHCTSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Signal peptidase IB (Staphylococcus aureus) | BDBM50441139 (ARYLOMYCIN C16) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Curated by ChEMBL | Assay Description Binding affinity to Staphylococcus aureus type-1 signal peptidase using decanoyl-LSSPAYNO2A-ADKabzPD and decanyol-LTPTAYNO2A-ASKKabzDD as substrate b... | Bioorg Med Chem Lett 23: 5654-9 (2013) Article DOI: 10.1016/j.bmcl.2013.08.026 BindingDB Entry DOI: 10.7270/Q22F7PVV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Signal peptidase I (Escherichia coli (strain K12)) | BDBM50441139 (ARYLOMYCIN C16) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a |
AstraZeneca Curated by ChEMBL | Assay Description Binding affinity to full length His-tagged Escherichia coli PAS0232 SPase 1 P84S mutant expressed in Escherichia coli BL21 (DE3) | Bioorg Med Chem Lett 24: 413-8 (2014) Article DOI: 10.1016/j.bmcl.2013.12.059 BindingDB Entry DOI: 10.7270/Q29K4F5D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Signal peptidase I (Escherichia coli (strain K12)) | BDBM50441139 (ARYLOMYCIN C16) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 979 | n/a | n/a | n/a | n/a | n/a |
AstraZeneca Curated by ChEMBL | Assay Description Binding affinity to full length His-tagged Escherichia coli MG1665 SPase 1 expressed in Escherichia coli BL21 (DE3) | Bioorg Med Chem Lett 24: 413-8 (2014) Article DOI: 10.1016/j.bmcl.2013.12.059 BindingDB Entry DOI: 10.7270/Q29K4F5D | |||||||||||
More data for this Ligand-Target Pair |