Compile Data Set for Download or QSAR

Found 10 hits of ic50 for UniProtKB: P54292   

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
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50470115 (CHEMBL4098007) Show SMILES C=CCSSc1nc2ccccc2s1 Show InChI InChI=1S/C10H9NS3/c1-2-7-12-14-10-11-8-5-3-4-6-9(8)13-10/h2-6H,1,7H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nanyang Technological University Curated by ChEMBL					Assay Description Inhibition of quorum sensing regulator protein RhlR in Pseudomonas aeruginosa PAO1 harboring reporter plasmid rhlA-gfp assessed as reduction in rhlA ...				J Med Chem 60: 215-227 (2017) Article DOI: 10.1021/acs.jmedchem.6b01025 BindingDB Entry DOI: 10.7270/Q2125WC6
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50465702 (CHEMBL4292339) Show SMILES Brc1cccc(OCCCCC(=O)NC2CCSC2=O)c1 Show InChI InChI=1S/C15H18BrNO3S/c16-11-4-3-5-12(10-11)20-8-2-1-6-14(18)17-13-7-9-21-15(13)19/h3-5,10,13H,1-2,6-9H2,(H,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Nottingham Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa GFP-fused RhlR expressed in Escherichia coli BL21-Gold (DE3) co-expressing rhlA promoter by beta-galactosidase r...				J Med Chem 61: 10385-10402 (2018) Article DOI: 10.1021/acs.jmedchem.8b00540 BindingDB Entry DOI: 10.7270/Q2XP77NZ
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM14324 (5,6-dimethyl-1H-1,3-benzodiazol-2-amine | Fragment...) Show SMILES Cc1cc2nc(N)[nH]c2cc1C Show InChI InChI=1S/C9H11N3/c1-5-3-7-8(4-6(5)2)12-9(10)11-7/h3-4H,1-2H3,(H3,10,11,12)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1016/j.ejmech.2022.114629 BindingDB Entry DOI: 10.7270/Q25M69PB
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50543115 (CHEMBL4642992) Show SMILES CCCC(=O)C#Cc1ccc(F)c(F)c1 Show InChI InChI=1S/C12H10F2O/c1-2-3-10(15)6-4-9-5-7-11(13)12(14)8-9/h5,7-8H,2-3H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Korea University Curated by ChEMBL					Assay Description Antagonist activity at Pseudomonas aeruginosa RhlR expressed in Escherichia coli DH5alpha incubated for 1.5 hrs by luminescence reporter gene assay				J Med Chem 63: 8388-8407 (2020) Article DOI: 10.1021/acs.jmedchem.0c00630 BindingDB Entry DOI: 10.7270/Q2NK3JM6
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50240785 ((E)-1-Allyldisulfanyl-3-(prop-2-ene-1-sulfinyl)-pr...) Show SMILES C=CCSS\C=C\CS(=O)CC=C Show InChI InChI=1S/C9H14OS3/c1-3-6-11-12-7-5-9-13(10)8-4-2/h3-5,7H,1-2,6,8-9H2/b7-5+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nanyang Technological University Curated by ChEMBL					Assay Description Inhibition of quorum sensing regulator protein RhlR in Pseudomonas aeruginosa PAO1 harboring reporter plasmid rhlA-gfp assessed as reduction in rhlA ...				J Med Chem 60: 215-227 (2017) Article DOI: 10.1021/acs.jmedchem.6b01025 BindingDB Entry DOI: 10.7270/Q2125WC6
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50240785 ((E)-1-Allyldisulfanyl-3-(prop-2-ene-1-sulfinyl)-pr...) Show SMILES C=CCSS\C=C\CS(=O)CC=C Show InChI InChI=1S/C9H14OS3/c1-3-6-11-12-7-5-9-13(10)8-4-2/h3-5,7H,1-2,6,8-9H2/b7-5+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Nottingham Curated by ChEMBL					Assay Description Inhibition of RhlR in Pseudomonas aeruginosa reporter strain harboring gfp-rhlA				J Med Chem 61: 10385-10402 (2018) Article DOI: 10.1021/acs.jmedchem.8b00540 BindingDB Entry DOI: 10.7270/Q2XP77NZ
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50543114 (CHEMBL4632586) Show SMILES CCCC(=O)NC1CCCC1 Show InChI InChI=1S/C9H17NO/c1-2-5-9(11)10-8-6-3-4-7-8/h8H,2-7H2,1H3,(H,10,11)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Korea University Curated by ChEMBL					Assay Description Antagonist activity at Pseudomonas aeruginosa RhlR expressed in Escherichia coli DH5alpha incubated for 1.5 hrs by luminescence reporter gene assay				J Med Chem 63: 8388-8407 (2020) Article DOI: 10.1021/acs.jmedchem.0c00630 BindingDB Entry DOI: 10.7270/Q2NK3JM6
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50210051 (CHEMBL3883439) Show SMILES CCCC(O)CC(=O)CCc1ccc(O)c(OC)c1 Show InChI InChI=1S/C15H22O4/c1-3-4-12(16)10-13(17)7-5-11-6-8-14(18)15(9-11)19-2/h6,8-9,12,16,18H,3-5,7,10H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.18E+5	n/a	n/a	n/a	n/a	n/a	n/a
Korea University Curated by ChEMBL					Assay Description Antagonist activity at Pseudomonas aeruginosa RhlR expressed in Escherichia coli DH5alpha incubated for 1.5 hrs by luminescence reporter gene assay				J Med Chem 63: 8388-8407 (2020) Article DOI: 10.1021/acs.jmedchem.0c00630 BindingDB Entry DOI: 10.7270/Q2NK3JM6
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM7960 (1H-1,3-benzodiazol-2-amine | 2-Aminobenzimidazole ...) Show SMILES Nc1nc2ccccc2[nH]1 Show InChI InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	2.85E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1016/j.ejmech.2022.114629 BindingDB Entry DOI: 10.7270/Q25M69PB
					More data for this Ligand-Target Pair
HTH-type quorum-sensing regulator RhlR (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50275147 (6-Gingerol | BDBM50317427 | CHEMBL446043 | Gingero...) Show SMILES CCCCC[C@H](O)CC(=O)CCc1ccc(O)c(OC)c1 |r| Show InChI InChI=1S/C17H26O4/c1-3-4-5-6-14(18)12-15(19)9-7-13-8-10-17(21-2)16(20)11-13/h8,10-11,14,18,20H,3-7,9,12H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.45E+5	n/a	n/a	n/a	n/a	n/a	n/a
Korea University Curated by ChEMBL					Assay Description Antagonist activity at Pseudomonas aeruginosa RhlR expressed in Escherichia coli DH5alpha incubated for 1.5 hrs by luminescence reporter gene assay				J Med Chem 63: 8388-8407 (2020) Article DOI: 10.1021/acs.jmedchem.0c00630 BindingDB Entry DOI: 10.7270/Q2NK3JM6
					More data for this Ligand-Target Pair