alvespimycin [Ligand Id: 9828] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL383824 (Alvespimicina, Alvespimycin, Alvespimycine, NSC-707545) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| Heat shock protein 90 beta in Dog (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4748] [UniProtKB: P41148] | ||||||||
| ChEMBL | Inhibition of BODIPY-AG binding to dog Grp94 | B | 7.19 | pEC50 | 65 | nM | EC50 | J Med Chem (2006) 49: 4606-4615 [PMID:16854066] |
| heat shock protein 90 alpha family class A member 1/Heat shock protein HSP 90-alpha in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3880] [GtoPdb: 2905] [UniProtKB: P07900] | ||||||||
| ChEMBL | Binding affinity for human heat shock protein 90 in scintillation proximity assay | B | 6.3 | pKd | 500 | nM | Kd | Bioorg Med Chem Lett (2005) 15: 5016-5021 [PMID:16165354] |
| ChEMBL | Binding affinity to human recombinant Hsp90alpha N-terminal domain by scintillation proximity assay | B | 6.3 | pKd | 500 | nM | Kd | J Med Chem (2009) 52: 1518-1521 [PMID:19231864] |
| ChEMBL | Binding affinity to human recombinant Hsp90alpha N-terminal domain by isothermal titration calorimetry | B | 7.06 | pKd | 87 | nM | Kd | J Med Chem (2009) 52: 1518-1521 [PMID:19231864] |
| ChEMBL | Displacement of [3H]-(R)-2-(5-chloro-2,4-dihydroxybenzoyl)-N-ethylisoindoline-1-carboxamide from human his(6)-tagged HSP90alpha after 30 mins by scintillation proximity assay | B | 6.17 | pKi | 680 | nM | Ki | J Med Chem (2011) 54: 3368-3385 [PMID:21438541] |
| ChEMBL | Inhibition of 6x-His tagged human recombinant full length Hsp90alpha ATPase preincubated for 0.5 hrs followed by ATP addition measured after 30 mins by HTRF assay | B | 6.04 | pIC50 | 919 | nM | IC50 | Bioorg Med Chem (2016) 24: 4626-4635 [PMID:27527413] |
| GtoPdb | - | - | 8.35 | pIC50 | 4.5 | nM | IC50 | Bioorg Med Chem Lett (2008) 18: 6273-8 [PMID:18929486] |
| heat shock protein 90 alpha family class B member 1/Heat shock protein HSP 90-beta in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4303] [GtoPdb: 2907] [UniProtKB: P08238] | ||||||||
| ChEMBL | Binding affinity to human recombinant HSP90 | B | 6.3 | pKd | 500 | nM | Kd | J Med Chem (2009) 52: 3265-3273 [PMID:19405528] |
| ChEMBL | Inhibition of full-length HSP90 (unknown origin) expressed in Escherichia coli assessed as inhibition of ATPase activity after 3 hrs by spectrophotometric analysis | B | 5.85 | pIC50 | 1410 | nM | IC50 | Eur J Med Chem (2014) 79: 399-412 [PMID:24763261] |
| ChEMBL | Inhibition of full-length Hsp90-ATPase activity (unknown origin) assessed as inhibition of ATP hydrolysis by spectrophotometry | B | 6.03 | pIC50 | 930 | nM | IC50 | Bioorg Med Chem Lett (2014) 24: 1557-1561 [PMID:24582477] |
| ChEMBL | Displacement of FITC-geldanamycin from HSP90 (unknown origin) after 30 mins by fluorescence polarization assay | B | 7.05 | pIC50 | 90 | nM | IC50 | Eur J Med Chem (2014) 79: 399-412 [PMID:24763261] |
| ChEMBL | Binding affinity to Hsp90 in human SKBR3 cells | B | 7.62 | pIC50 | 24 | nM | IC50 | Bioorg Med Chem (2009) 17: 2225-2235 [PMID:19017562] |
| Hypoxia-inducible factor 1 alpha in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4261] [UniProtKB: Q16665] | ||||||||
| ChEMBL | Inhibition of hypoxia-induced HIF1alpha protein accumulation in human Hep3B cells treated for 30 mins measured after 12 hrs by Western blot analysis | F | 7.24 | pIC50 | 57.2 | nM | IC50 | J Nat Prod (2009) 72: 39-43 [PMID:19072214] |
| ChEMBL | Inhibition of hypoxia-induced HIF1alpha protein accumulation in human Hep3B cells treated for 30 mins measured after 12 hrs by Western blot analysis | F | 7.24 | pIC50 | 57 | nM | IC50 | J Nat Prod (2010) 73: 1167-1169 [PMID:20469887] |
| lysine demethylase 4B/Lysine-specific demethylase 4B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3313832] [GtoPdb: 2676] [UniProtKB: O94953] | ||||||||
| ChEMBL | Inhibition of KDM4B (unknown origin) measured by AlphaScreen assay | B | 6.15 | pIC50 | 700 | nM | IC50 | J Med Chem (2022) 65: 9564-9579 [PMID:35838529] |
| lysine demethylase 4C/Lysine-specific demethylase 4C in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6175] [GtoPdb: 2677] [UniProtKB: Q9H3R0] | ||||||||
| ChEMBL | Inhibition of KDM4C (unknown origin) measured by AlphaScreen assay | B | 6.15 | pIC50 | 700 | nM | IC50 | J Med Chem (2022) 65: 9564-9579 [PMID:35838529] |
| lysine demethylase 5A/Lysine-specific demethylase 5A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2424504] [GtoPdb: 2680] [UniProtKB: P29375] | ||||||||
| ChEMBL | Inhibition of KDM5A (unknown origin) measured by AlphaScreen assay | B | 6.89 | pIC50 | 130 | nM | IC50 | J Med Chem (2022) 65: 9564-9579 [PMID:35838529] |
| lysine demethylase 6B/Lysine-specific demethylase 6B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1938211] [GtoPdb: 2685] [UniProtKB: O15054] | ||||||||
| ChEMBL | Inhibition of KDM6B (unknown origin) measured by AlphaScreen assay | B | 6.4 | pIC50 | 400 | nM | IC50 | J Med Chem (2022) 65: 9564-9579 [PMID:35838529] |
ChEMBL data shown on this page come from version 35:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]
