BDBM50422012 Klinomycin::MINOCYCLINE::Minocin::Vectrin
SMILES: CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(ccc(O)c4C(=O)C3C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O)N(C)C
InChI Key: InChIKey=ZZZRUAITSXLWBH-CSYJEMQYSA-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 |
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protein-arginine deiminase type-4 (Homo sapiens (Human)) | BDBM50422012 (Klinomycin | MINOCYCLINE | Minocin | Vectrin) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | 1.80E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of South Carolina Curated by ChEMBL | Assay Description Inhibition of PAD4 measured by intercept plot of Lineweaver-Burke analyses | Bioorg Med Chem 16: 739-45 (2008) Article DOI: 10.1016/j.bmc.2007.10.021 BindingDB Entry DOI: 10.7270/Q24F1RKF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
protein-arginine deiminase type-4 (Homo sapiens (Human)) | BDBM50422012 (Klinomycin | MINOCYCLINE | Minocin | Vectrin) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | 5.40E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of South Carolina Curated by ChEMBL | Assay Description Inhibition of PAD4 measured by slope plot of Lineweaver-Burke analyses | Bioorg Med Chem 16: 739-45 (2008) Article DOI: 10.1016/j.bmc.2007.10.021 BindingDB Entry DOI: 10.7270/Q24F1RKF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Multidrug translocase mdfA (Escherichia coli (strain K12)) | BDBM50422012 (Klinomycin | MINOCYCLINE | Minocin | Vectrin) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tufts University Curated by ChEMBL | Assay Description Inhibition of [3H]tetracycline uptake into everted membrane vesicles, prepared from tetracycline resistant Escherichia coli D1-209 | J Med Chem 36: 370-7 (1993) BindingDB Entry DOI: 10.7270/Q2XW4KDW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
protein-arginine deiminase type-4 (Homo sapiens (Human)) | BDBM50422012 (Klinomycin | MINOCYCLINE | Minocin | Vectrin) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of South Carolina Curated by ChEMBL | Assay Description Inhibition of PAD4 by ABPP-based assay | Bioorg Med Chem 16: 739-45 (2008) Article DOI: 10.1016/j.bmc.2007.10.021 BindingDB Entry DOI: 10.7270/Q24F1RKF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serum albumin (Homo sapiens (Human)) | BDBM50422012 (Klinomycin | MINOCYCLINE | Minocin | Vectrin) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a |
CNRS-CPBS/UMR 5236 Curated by ChEMBL | Assay Description Binding affinity to first site on human serum albumin by SPR | Antimicrob Agents Chemother 53: 1528-31 (2009) Article DOI: 10.1128/AAC.00971-08 BindingDB Entry DOI: 10.7270/Q2SN09ZK | |||||||||||
More data for this Ligand-Target Pair |