Found 40 hits for monomerid = 13061 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 |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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| DrugBank Article PubMed
| 0.0200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Purdue University
Curated by ChEMBL
| Assay Description Competitive inhibition of human aromatase using dibenzylfluorescein substrate after 10 mins preincubation measured every 10 sec for 5 mins by Michael... |
Bioorg Med Chem 20: 2427-34 (2012)
Article DOI: 10.1016/j.bmc.2012.01.047 BindingDB Entry DOI: 10.7270/Q2DJ5G3W |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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| DrugBank Article PubMed
| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Coimbra
Curated by ChEMBL
| Assay Description Inhibition of human aromatase-mediated conversion of [1beta3H]androstenedione to estrone by Lineweaver-Burk plot in presence of NADPH |
J Med Chem 52: 143-50 (2009)
Article DOI: 10.1021/jm800945c BindingDB Entry DOI: 10.7270/Q2SQ9080 |
More data for this Ligand-Target Pair | |
Aromatase cytochrome P450
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | GoogleScholar AffyNet
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Patents
Similars
| Article PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Biomolécules et Cibles Cellulaires Tumorales
| Assay Description The inhibitory activities of the compounds toward aromatase were determined in vitro using human placental microsomes and [1,2,6,7-3H]-androstenedion... |
Bioorg Chem 32: 494-503 (2004)
Article DOI: 10.1016/j.bioorg.2004.06.008 BindingDB Entry DOI: 10.7270/Q21R6P2Z |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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| DrugBank Article PubMed
| n/a | n/a | 2.80 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Yueyang Vocational Technical College
| Assay Description This fluorescence-based assay measures the rate at which recombinant
human aromatase (baculovirus/insect cell-expressed) converts the
substrate 7-m... |
Chem Biol Drug Des 88: 832-843 (2016)
Article DOI: 10.1111/cbdd.12812 BindingDB Entry DOI: 10.7270/Q2HM578V |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Similars
| DrugBank Article PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Purdue University
Curated by ChEMBL
| Assay Description Inhibition of human aromatase using dibenzylfluorescein substrate preincubated for 30 mins measured after 30 mins by fluorescence assay |
Bioorg Med Chem 20: 2427-34 (2012)
Article DOI: 10.1016/j.bmc.2012.01.047 BindingDB Entry DOI: 10.7270/Q2DJ5G3W |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Similars
| DrugBank Article PubMed
| n/a | n/a | 5.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Purdue University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant aromatase using 7-methoxy-trifluoromethylcoumarin as substrate assessed as formation of fluorescent metabolite after ... |
J Med Chem 58: 2623-48 (2015)
Article DOI: 10.1021/jm501218e BindingDB Entry DOI: 10.7270/Q2TX3H32 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Srinakharinwirot University
Curated by ChEMBL
| Assay Description Inhibition of CYP19 (unknown origin) using O-benzyl fluorescein benzyl ester substrate preincubated for 10 mins by fluorimetric analysis relative to ... |
Bioorg Med Chem 23: 3472-80 (2015)
Article DOI: 10.1016/j.bmc.2015.04.036 BindingDB Entry DOI: 10.7270/Q2CC12FV |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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| DrugBank PubMed
| n/a | n/a | 0.890 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bath
Curated by ChEMBL
| Assay Description Inhibition of aromatase (unknown origin) expressed in JEG-3 cells |
J Med Chem 58: 7634-58 (2015)
BindingDB Entry DOI: 10.7270/Q2474CP9 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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| DrugBank Article PubMed
| n/a | n/a | 11.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Nantes
Curated by ChEMBL
| Assay Description Inhibition of aromatase in human placental microsomes |
Bioorg Med Chem Lett 18: 4713-5 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.094 BindingDB Entry DOI: 10.7270/Q2HD7VF7 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 6.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Coimbra
Curated by ChEMBL
| Assay Description Inhibition of human aromatase-mediated conversion of [1beta3H]androstenedione to estrone by liquid scintillation counting in presence of NADPH |
J Med Chem 52: 143-50 (2009)
Article DOI: 10.1021/jm800945c BindingDB Entry DOI: 10.7270/Q2SQ9080 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
Similars
| DrugBank PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Chieti 'G. d'Annunzio'
Curated by ChEMBL
| Assay Description Inhibition of recombinant human aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate measured at anoxic conditions by fluorescence analy... |
Bioorg Med Chem Lett 26: 3192-4 (2016)
BindingDB Entry DOI: 10.7270/Q29C70CS |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
UPRES EA 4021 Biomol�cules et Th�rapies anti-tumorales
Curated by ChEMBL
| Assay Description Inhibition of aromatase in human placental microsomes assessed as inhibition of aromatization of [1,2,6,7-3H] androstenedione by flow scintillation a... |
Eur J Med Chem 46: 2541-5 (2011)
Article DOI: 10.1016/j.ejmech.2011.03.043 BindingDB Entry DOI: 10.7270/Q2MC90CB |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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CHEMBL DrugBank KEGG PC cid PC sid UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 4.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universita` di Modena e Reggio Emilia
Curated by ChEMBL
| Assay Description Inhibition of human recombinant aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate by fluorimetric analysis |
J Med Chem 54: 4006-17 (2011)
Article DOI: 10.1021/jm2000689 BindingDB Entry DOI: 10.7270/Q2N58MPP |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Moncton
Curated by ChEMBL
| Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis |
Eur J Med Chem 46: 4010-24 (2011)
Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank KEGG PC cid PC sid UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of human aromatase coexpressed with P450 reductase by fluorimetry |
Bioorg Med Chem Lett 22: 1860-3 (2012)
Article DOI: 10.1016/j.bmcl.2012.01.076 BindingDB Entry DOI: 10.7270/Q2571CGS |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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CHEMBL DrugBank KEGG PC cid PC sid UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 5.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Purdue University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CYP19 expressed in baculovirus infected insect cells using MFC as substrate measured after 30 mins by fluorometric an... |
Bioorg Med Chem 24: 5400-5409 (2016)
Article DOI: 10.1016/j.bmc.2016.08.064 BindingDB Entry DOI: 10.7270/Q2JQ12ZK |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Padova
Curated by ChEMBL
| Assay Description Inhibition of aromatase (unknown origin) using 7-methoxy-4-trifluoromethylcoumarin as substrate after 30 mins by fluorimetric analysis |
J Med Chem 56: 7536-51 (2013)
Article DOI: 10.1021/jm400377z BindingDB Entry DOI: 10.7270/Q2M046WV |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 2.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Northern Kentucky University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant aromatase expressed in baculovirus-infected cell system using 7-methoxy-trifluoromethylcoumarin as substrate after 30... |
Bioorg Med Chem 22: 126-34 (2013)
Article DOI: 10.1016/j.bmc.2013.11.045 BindingDB Entry DOI: 10.7270/Q2D79CXT |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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CHEMBL DrugBank KEGG PC cid PC sid UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Saarland University& Helmholtz Institute for Pharmaceutical Research Saarland (HIPS)
Curated by ChEMBL
| Assay Description Inhibition of human CYP19 using [1beta-3H]androstenedione as substrate by 3H2O method |
J Med Chem 56: 460-70 (2013)
Article DOI: 10.1021/jm301408t BindingDB Entry DOI: 10.7270/Q2X34ZSF |
More data for this Ligand-Target Pair | |
Cytochrome P450 11B2 (CYP11B2)
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
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Patents
Similars
| Article PubMed
| n/a | n/a | 1.42E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Saarland University& Helmholtz Institute for Pharmaceutical Research Saarland (HIPS)
Curated by ChEMBL
| Assay Description Inhibition of human CYP11B2 expressed in hamster V79MZh cells using [1,2-3H]-11-deoxy-corticosterone as substrate |
J Med Chem 56: 460-70 (2013)
Article DOI: 10.1021/jm301408t BindingDB Entry DOI: 10.7270/Q2X34ZSF |
More data for this Ligand-Target Pair | |
Cytochrome P450 11B1, mitochondrial
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB
KEGG
UniProtKB/SwissProt
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CHEMBL DrugBank KEGG PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Saarland University& Helmholtz Institute for Pharmaceutical Research Saarland (HIPS)
Curated by ChEMBL
| Assay Description Inhibition of human CYP11B1 expressed in hamster V79MZh cells using [1,2-3H]-11-deoxy-corticosterone as substrate |
J Med Chem 56: 460-70 (2013)
Article DOI: 10.1021/jm301408t BindingDB Entry DOI: 10.7270/Q2X34ZSF |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank KEGG PC cid PC sid UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Key Laboratory of Medicinal Chemistry for Natural Resource (Yunnan University)
Curated by ChEMBL
| Assay Description Inhibition of human placental microsome aromatase after 30 mins by ELISA |
Bioorg Med Chem Lett 23: 1760-2 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.045 BindingDB Entry DOI: 10.7270/Q2RN396J |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 11.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by ChEMBL
| Assay Description Inhibition of human placental microsome CYP19 |
Bioorg Med Chem Lett 20: 3050-64 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.113 BindingDB Entry DOI: 10.7270/Q2CJ8FFS |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 0.890 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bath
Curated by ChEMBL
| Assay Description Inhibition of aromatse in human JEG3 cells by scintillation spectrometry |
J Med Chem 53: 2155-70 (2010)
Article DOI: 10.1021/jm901705h BindingDB Entry DOI: 10.7270/Q2959JGF |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 9.90 | n/a | n/a | n/a | n/a | n/a | n/a |
State University of New York Upstate Medical University
Curated by ChEMBL
| Assay Description Inhibition of human placental aromatase using [3H]-1beta-androstenedione as substrate after 16 hrs by [3H]-water method |
J Med Chem 55: 8464-76 (2012)
Article DOI: 10.1021/jm300930n BindingDB Entry DOI: 10.7270/Q2BZ675S |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 2.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of aromatase activity in human T47D cells after 24 hrs |
Eur J Med Chem 124: 946-958 (2016)
Article DOI: 10.1016/j.ejmech.2016.10.020 BindingDB Entry DOI: 10.7270/Q2F76FPP |
More data for this Ligand-Target Pair | |
Bile salt export pump
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB
UniProtKB/SwissProt
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| Article PubMed
| n/a | n/a | 2.25E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description Inhibition of human BSEP expressed in baculovirus transfected fall armyworm Sf21 cell membranes vesicles assessed as reduction in ATP-dependent [3H]-... |
Drug Metab Dispos 40: 2332-41 (2012)
Article DOI: 10.1124/dmd.112.047068 BindingDB Entry DOI: 10.7270/Q2ZP488M |
More data for this Ligand-Target Pair | |
Bile salt export pump
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB
UniProtKB/SwissProt
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| PubMed
| n/a | n/a | 1.33E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc
Curated by ChEMBL
| Assay Description Inhibition of human BSEP overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-taurocholate in presence of ATP measured after 15 to ... |
Toxicol Sci 136: 216-41 (2013)
BindingDB Entry DOI: 10.7270/Q2JM2D2D |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 2.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of aromatase activity in human T47D cells after 24 hrs |
Eur J Med Chem 134: 304-315 (2017)
Article DOI: 10.1016/j.ejmech.2017.04.028 BindingDB Entry DOI: 10.7270/Q28K7CJB |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Yunnan University
Curated by ChEMBL
| Assay Description Inhibition of human aromatase using androstenedione as substrate and NADPH preincubated for 24 hrs followed by substrate addition measured after 24 h... |
Eur J Med Chem 143: 426-437 (2018)
Article DOI: 10.1016/j.ejmech.2017.11.057 BindingDB Entry DOI: 10.7270/Q24M973Q |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Srinakharinwirot University
Curated by ChEMBL
| Assay Description Inhibition of aromatase (unknown origin) using O-benzyl fluorescein benzyl ester as substrate in presence of NADPH-generating system by fluorescence ... |
Eur J Med Chem 143: 1604-1615 (2018)
Article DOI: 10.1016/j.ejmech.2017.10.057 BindingDB Entry DOI: 10.7270/Q22V2JM9 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Hawai'i at Hilo
Curated by ChEMBL
| Assay Description Inhibition of CYP19A1 (unknown origin) preincubated with NADPH followed by DBF substrate addition after 30 mins by fluorescence based assay |
Bioorg Med Chem Lett 27: 5393-5399 (2017)
Article DOI: 10.1016/j.bmcl.2017.11.010 BindingDB Entry DOI: 10.7270/Q26W9DNB |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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| DrugBank Article PubMed
| n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
"G. d'Annunzio" University
Curated by ChEMBL
| Assay Description Inhibition of aromatase in human MCF-7aro cells using [1beta-3H] androstenedione as substrate incubated for 1 hr by liquid scintillation counting met... |
Eur J Med Chem 185: (2020)
Article DOI: 10.1016/j.ejmech.2019.111815 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Key Laboratory of Industrial Fermentation Microbiology (Tianjin University of Science & Technology)
Curated by ChEMBL
| Assay Description Inhibition of recombinant human aromatase using 7-methoxy-trifluoromethylcoumarin as substrate incubated for 30 mins by fluorescence microplate reade... |
Bioorg Med Chem 24: 4723-4730 (2016)
Article DOI: 10.1016/j.bmc.2016.08.014 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
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| DrugBank Article PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Key Laboratory of Industrial Fermentation Microbiology (Tianjin University of Science & Technology)
Curated by ChEMBL
| Assay Description Inhibition of recombinant human aromatase using 7-methoxy-trifluoromethylcoumarin as substrate incubated for 30 mins by fluorescence microplate reade... |
Bioorg Med Chem 24: 4723-4730 (2016)
Article DOI: 10.1016/j.bmc.2016.08.014 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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Patents
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| DrugBank Article PubMed
| n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Srinakharinwirot University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human aromatase expressed in baculovirus infected insect cells using O-benzyl fluorescein benzyl ester as substrate in pres... |
Bioorg Med Chem 27: (2019)
Article DOI: 10.1016/j.bmc.2019.08.001 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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| DrugBank Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
CNR-IOM-Democritos c/o International School for Advanced Studies (SISSA)
Curated by ChEMBL
| Assay Description Inhibition of recombinant human aromatase preincubated for 10 mins followed by substrate and beta-NADP+ addition and measured for 60 mins by fluoresc... |
Eur J Med Chem 168: 253-262 (2019)
Article DOI: 10.1016/j.ejmech.2019.02.045 |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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| DrugBank PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Alma Mater Studiorum-University of Bologna
Curated by ChEMBL
| Assay Description Inhibition of human aromatase using ASD as substrate incubated for 16 hrs by UV/vis-spectrophotometry |
ACS Med Chem Lett 11: 732-739 (2020)
|
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
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Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | 7.8 | 20 |
University of Bath
| Assay Description The in vitro inhibition of carbonic anhydrase was assessed by a colorimetric assay. Carbonic anhydrase-catalysed hydrolysis of p-nitrophenyl acetate ... |
Biochemistry 44: 6858-66 (2005)
Article DOI: 10.1021/bi047692e BindingDB Entry DOI: 10.7270/Q2125QVD |
More data for this Ligand-Target Pair | |
Cytochrome P450 19A1
(Homo sapiens (Human)) | BDBM13061
(4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...)Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
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| DrugBank Article PubMed
| n/a | n/a | 0.890 | n/a | n/a | n/a | n/a | 7.5 | 37 |
University of Bath
| Assay Description The extent of in vitro inhibition of aromatase activities was assessed using intact monolayers of JEG-3 cells. Aromatase activity was measured using ... |
J Med Chem 51: 4226-38 (2008)
Article DOI: 10.1021/jm800168s BindingDB Entry DOI: 10.7270/Q26W98DJ |
More data for this Ligand-Target Pair | |