BDBM50226518 3-Aminobenzoesaeure::3-aminobenzoic acid::CHEMBL307782::m-Aminobenzoesaeure
SMILES: Nc1cccc(c1)C(O)=O
InChI Key: InChIKey=XFDUHJPVQKIXHO-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Proton-coupled amino acid transporter 1 (Homo sapiens (Human)) | BDBM50226518 (3-Aminobenzoesaeure | 3-aminobenzoic acid | CHEMBL...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | 1.20E+7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Martin-Luther-University Halle-Wittenberg Curated by ChEMBL | Assay Description Inhibition of human PAT1-mediated L-[3H]proline uptake in human Caco2 cells after 10 mins by liquid scintillation counting | Bioorg Med Chem 19: 6409-18 (2011) Checked by Author Article DOI: 10.1016/j.bmc.2011.08.058 BindingDB Entry DOI: 10.7270/Q2NZ882D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D-Aspartate Oxidase (DDO) (Homo sapiens (Human)) | BDBM50226518 (3-Aminobenzoesaeure | 3-aminobenzoic acid | CHEMBL...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | PubMed | n/a | n/a | >1.00E+7 | n/a | n/a | n/a | n/a | n/a | n/a |
Kitasato University Curated by ChEMBL | Assay Description Inhibition of human recombinant DDO expressed in Escherichia coli BL21(DE3) using D-Asp and D-Ala assessed as 2-oxo acid production after 10 mins by ... | J Med Chem 58: 7328-40 (2015) BindingDB Entry DOI: 10.7270/Q2WM1G6R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Casein kinase II subunit alpha (Homo sapiens (Human)) | BDBM50226518 (3-Aminobenzoesaeure | 3-aminobenzoic acid | CHEMBL...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | n/a | n/a | n/a | >5.00E+5 | n/a | n/a | n/a | n/a | n/a |
Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, UK. Curated by ChEMBL | Assay Description Binding affinity to CK2alpha (unknown origin) by ITC | Bioorg Med Chem 25: 3471-3482 (2017) Article DOI: 10.1016/j.bmc.2017.04.037 BindingDB Entry DOI: 10.7270/Q29G5Q8D | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Gamma-amino-N-butyrate transaminase (Homo sapiens (Human)) | BDBM50226518 (3-Aminobenzoesaeure | 3-aminobenzoic acid | CHEMBL...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | >5.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University Curated by ChEMBL | Assay Description Inhibition of GABA-AT | Bioorg Med Chem Lett 18: 3122-5 (2008) Article DOI: 10.1016/j.bmcl.2007.10.060 BindingDB Entry DOI: 10.7270/Q22J6CRF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D-amino-acid oxidase (Homo sapiens (Human)) | BDBM50226518 (3-Aminobenzoesaeure | 3-aminobenzoic acid | CHEMBL...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | PubMed | n/a | n/a | 3.92E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Kitasato University Curated by ChEMBL | Assay Description Inhibition of human recombinant DAO expressed in Escherichia coli BL21(DE3) using D-Asp and D-Ala assessed as 2-oxo acid production after 10 mins by ... | J Med Chem 58: 7328-40 (2015) BindingDB Entry DOI: 10.7270/Q2WM1G6R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Human diphtheria toxin-like ADP-ribosyltransferase (ARTD3 or PARP3) (Homo sapiens (Human)) | BDBM50226518 (3-Aminobenzoesaeure | 3-aminobenzoic acid | CHEMBL...) | PDB MMDB KEGG B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | n/a | n/a | n/a | >2.00E+3 | n/a | n/a | n/a | n/a | n/a |
Institutet Curated by ChEMBL | Assay Description Binding affinity to human PARP3 PARP domain by isothermal titration colorimetry | J Med Chem 52: 3108-11 (2009) Article DOI: 10.1021/jm900052j BindingDB Entry DOI: 10.7270/Q2B56JNV | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |