BDBM50145829 4-Aminobenzoesaeure::4-aminobenzoic acid::CHEMBL542::PABA::p-Aminobenzoesaeure::p-aminobenzoic acid::para-aminobenzoic acid

SMILES: Nc1ccc(cc1)C(O)=O

InChI Key: InChIKey=ALYNCZNDIQEVRV-UHFFFAOYSA-N

Data: 7 IC50  2 Kd

PDB links: 10 PDB IDs match 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 9 hits for monomerid = 50145829   

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
Hepatitis C virus serine protease, NS3/NS4A (Hepatitis C virus)	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Dissociation constant for HCV NS3 protease substrate binding site				J Med Chem 47: 2486-98 (2004) Article DOI: 10.1021/jm0305117 BindingDB Entry DOI: 10.7270/Q2FF3RSP
					More data for this Ligand-Target Pair
Succinate semialdehyde dehydrogenase (Homo sapiens (Human))	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Huazhong University of Science and Technology Curated by ChEMBL					Assay Description Inhibitory activity against SSADH				Bioorg Med Chem Lett 16: 592-5 (2005) Article DOI: 10.1016/j.bmcl.2005.10.040 BindingDB Entry DOI: 10.7270/Q29G5MCH
					More data for this Ligand-Target Pair
Gamma-amino-N-butyrate transaminase (Homo sapiens (Human))	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Huazhong University of Science and Technology Curated by ChEMBL					Assay Description Inhibitory activity against GABAT				Bioorg Med Chem Lett 16: 592-5 (2005) Article DOI: 10.1016/j.bmcl.2005.10.040 BindingDB Entry DOI: 10.7270/Q29G5MCH
					More data for this Ligand-Target Pair
Cytochrome P450 1B1 (Homo sapiens (Human))	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	>1.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Whittier College Curated by ChEMBL					Assay Description Inhibition of recombinant human CYP1B1 expressed in Escherichia coli DH5aplha cells assessed as O-deethylation of ethoxyresorufin in presence of NADP...				Bioorg Med Chem Lett 26: 3243-3247 (2016) BindingDB Entry DOI: 10.7270/Q2XG9T1M
					More data for this Ligand-Target Pair
Tyrosinase (Agaricus bisporus (Common mushroom))	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hinoki Shinyaku Co., Ltd Curated by ChEMBL					Assay Description Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as dopachrome formation preincubated for 10 mins followed by protein additio...				Bioorg Med Chem 24: 4509-4515 (2016) Article DOI: 10.1016/j.bmc.2016.07.060
					More data for this Ligand-Target Pair
Thiopurine S-methyltransferase (Homo sapiens (Human))	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	2.88E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of purified human kidney thiopurine methyltransferase (TPMT)				J Med Chem 29: 354-8 (1986) BindingDB Entry DOI: 10.7270/Q2445NPZ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	35.2	n/a	n/a	n/a	n/a	n/a	n/a
Punjabi University Curated by ChEMBL					Assay Description Inhibition of AChE activity in rat brain homogenate using acetylthiocholine as substrate by Ellman's method				Bioorg Med Chem 20: 521-30 (2011) Article DOI: 10.1016/j.bmc.2011.05.027 BindingDB Entry DOI: 10.7270/Q22B903F
					More data for this Ligand-Target Pair
Tyrosinase (Agaricus bisporus (Common mushroom))	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hinoki Shinyaku Co., Ltd Curated by ChEMBL					Assay Description Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as dopachrome formation preincubated for 10 mins followed by protein additio...				Bioorg Med Chem 24: 4509-4515 (2016) Article DOI: 10.1016/j.bmc.2016.07.060
					More data for this Ligand-Target Pair
Dihydropteroate synthase (Bacillus anthracis)	BDBM50145829 (4-Aminobenzoesaeure | 4-aminobenzoic acid | CHEMBL...) Show SMILES Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	5.62E+3	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Science Center Curated by ChEMBL					Assay Description Binding affinity to Bacillus anthracis DHPS expressed in Escherichia coli BL21 (DE3) after 30 mins by isothermal titration calorimetry				J Med Chem 53: 166-77 (2010) Article DOI: 10.1021/jm900861d BindingDB Entry DOI: 10.7270/Q2125TMH
					More data for this Ligand-Target Pair