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BDBM34180 3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulfonyl]-1H-pyrazol-5-amine::5-(3,4-dimethoxyphenyl)-2-(2,3,4,5,6-pentafluorophenyl)sulfonyl-3-pyrazolamine::5-(3,4-dimethoxyphenyl)-2-(2,3,4,5,6-pentafluorophenyl)sulfonylpyrazol-3-amine::5-(3,4-dimethoxyphenyl)-2-[2,3,4,5,6-pentakis(fluoranyl)phenyl]sulfonyl-pyrazol-3-amine::MLS000045819::SMR000028216::[5-(3,4-dimethoxyphenyl)-2-(2,3,4,5,6-pentafluorophenyl)sulfonyl-pyrazol-3-yl]amine::cid_3237441
SMILES: COc1ccc(cc1OC)-c1cc(N)n(n1)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F
InChI Key: InChIKey=PHKZOYOYFRWNDT-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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Bfl-1 (Mus musculus (Mouse)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet  | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 5.82E+3 | n/a | n/a | n/a | n/a | 7.0 | 23 |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description The aim is to identify chemical probes of Bfl-1 through a fluorescence polarization assay (FPA) using FITC-Bid BH3 peptide. 1) Dose-response curves c... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2N014W6 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Serine/threonine-protein kinase RIPK2 (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 951 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2T15278 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Bfl-1 (Mus musculus (Mouse)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 4.96E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanford-Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (San Diego, CA) NIH Molecular Libraries Screening Cen... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2K072NW | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Bfl-1 (Mus musculus (Mouse)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 4.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanford-Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (San Diego, CA) NIH Molecular Libraries Screening Cen... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2K072NW | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| G-protein coupled receptor 55 (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 1.18E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2348HSG | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| heat shock protein 90 (Candida albicans) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | n/a | n/a | >1.60E+5 | n/a | n/a | n/a | n/a |
Broad Institute Curated by PubChem BioAssay | Assay Description Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q26M358G | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| nucleotide-binding oligomerization domain containing 1 (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 1.62E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q23J3BDQ | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| nucleotide-binding oligomerization domain containing 2 (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 1.64E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2ZS2TX1 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Tumor necrosis factor (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 1.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2V1237V | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Beta-galactosidase (Escherichia coli) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | >6.66E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, C... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2NG4P4X | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| C-C chemokine receptor type 6 (CCR6) (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 3.26E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q20P0XHD | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Hepatocyte nuclear factor 4-alpha (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 6.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2736PH3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| perilipin-1 (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 9.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2CV4GBF | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Beta lactamase (Pseudomonas aeruginosa) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 3.43E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2XS5T0R | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| perilipin-5 (Homo sapiens (Human)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 6.83E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q24B2ZW9 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Bfl-1 (Mus musculus (Mouse)) | BDBM34180 (3-(3,4-dimethoxyphenyl)-1-[(pentafluorophenyl)sulf...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 5.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanford-Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2X065GM | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
