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ChEMBL ligand: CHEMBL254129 ([3H]-Cyclopamine, Cyclopamine) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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SMO/Smoothened homolog in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5971] [GtoPdb: 239] [UniProtKB: Q99835] | ||||||||
ChEMBL | Binding affinity to Smo D473H mutant expressed in U2OS cells by scintillation counting | B | 6.94 | pKd | 116 | nM | Kd | Bioorg Med Chem (2012) 20: 6751-6757 [PMID:23063522] |
ChEMBL | Binding affinity to wild type Smo expressed in U2OS cells by scintillation counting | B | 7.91 | pKd | 12.4 | nM | Kd | Bioorg Med Chem (2012) 20: 6751-6757 [PMID:23063522] |
ChEMBL | Displacement of [3H]cyclopamine from Smo D473H mutant expressed in U2OS cells after 2 hrs by scintillation counting | B | 6.63 | pKi | 232 | nM | Ki | Bioorg Med Chem (2012) 20: 6751-6757 [PMID:23063522] |
ChEMBL | Displacement of [3H]-cyclopamine from SMO V404M mutant in gefitinib resistant human HCC827 cells by scintillation counting | B | 7.29 | pKi | 51 | nM | Ki | J Med Chem (2017) 60: 7447-7458 [PMID:28787156] |
ChEMBL | Displacement of [3H]cyclopamine from wild type Smo expressed in U2OS cells after 2 hrs by scintillation counting | B | 7.9 | pKi | 12.7 | nM | Ki | Bioorg Med Chem (2012) 20: 6751-6757 [PMID:23063522] |
ChEMBL | Inhibition of Smo-mediated Hh signaling in human Shh-light2 cells by luciferase reporter gene assay | F | 6.52 | pIC50 | 300 | nM | IC50 | J Med Chem (2012) 55: 1559-1571 [PMID:22268551] |
ChEMBL | Antagonist activity at human Smo receptor expressed in CHO cells by [3H]Hh-Ag binding assay | B | 6.55 | pIC50 | 280 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 328-331 [PMID:19091559] |
ChEMBL | Displacement of BODIPY-labelled cyclopamine from human Smo receptor expressed in HEK293 cells after 2 hrs by fluorescence microscopy | B | 7.19 | pIC50 | 64 | nM | IC50 | J Med Chem (2012) 55: 1559-1571 [PMID:22268551] |
SMO/Smoothened homolog in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6080] [GtoPdb: 239] [UniProtKB: P56726] | ||||||||
ChEMBL | Inhibition of Smo in mouse Ptch-deficient MEF cells assessed as inhibition of Shh-induced Gli-responsive betagalactosidase activity after 30 hrs by BetaGLo assay | B | 5.72 | pIC50 | 1900 | nM | IC50 | ACS Med Chem Lett (2012) 3: 808-813 [PMID:23074541] |
ChEMBL | Inhibition of Smo in mouse Ptch-deficient MEF cells assessed as inhibition of Shh-induced Gli1 transcriptional activity | B | 5.82 | pIC50 | 1500 | nM | IC50 | ACS Med Chem Lett (2012) 3: 808-813 [PMID:23074541] |
ChEMBL | Antagonist activity at mouse Smo receptor expressed in CHO cells by [3H]Hh-Ag binding assay | B | 5.92 | pIC50 | 1200 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 328-331 [PMID:19091559] |
ChEMBL | Antagonist activity at Smo in mouse Shh-Light 2 cells assessed as inhibition of Shh-induced Gli1-reporter activity after 2 days by dual-luciferase reporter gene method | F | 6.32 | pIC50 | 484 | nM | IC50 | Bioorg Med Chem (2012) 20: 6751-6757 [PMID:23063522] |
GtoPdb | Measuring inhibition of Hh pathway signalling in Gli-dependent reporter assays in Shh-LIGHT2 cells. | - | 7 | pIC50 | ~100 | nM | IC50 | Bioorg Med Chem (2016) 24: 3752-7 [PMID:27338657] |
Sonic hedgehog protein in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5602] [UniProtKB: Q15465] | ||||||||
ChEMBL | Inhibition of human Shh-induced mouse C3H10T1/2 cell differentiation after 48 hrs by alkaline phosphatase reporter assay | B | 6.22 | pIC50 | 600 | nM | IC50 | ACS Med Chem Lett (2012) 3: 808-813 [PMID:23074541] |
Sonic hedgehog protein in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5387] [UniProtKB: Q62226] | ||||||||
ChEMBL | Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG | F | 5.88 | pIC50 | 1312 | nM | IC50 | Bioorg Med Chem (2009) 17: 4943-4954 [PMID:19541490] |
ChEMBL | Inhibition of N-terminal SHH activated pathway in mouse C3H10T1/2 cells assessed as SAG-induced cell differentiation by alkaline phosphatase assay | B | 6.22 | pIC50 | 600 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 3608-3612 [PMID:21592788] |
ChEMBL | Inhibition of SHH pathway in mouse Shh Light2 cells after 40 hrs by Gli-dependent luciferase reporter gene assay | F | 6.52 | pIC50 | 300 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 3608-3612 [PMID:21592788] |
ChEMBL | Inhibition of SHH in mouse Shh Light2 cells by GLI-responsive firefly luciferase reporter gene assay | F | 6.3 | pEC50 | 500 | nM | EC50 | J Med Chem (2009) 52: 3829-3845 [PMID:19309080] |
Zinc finger protein GLI1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5461] [UniProtKB: P08151] | ||||||||
ChEMBL | Inhibition of 100 nM SAG-stimulated Gli1 (unknown origin)-mediated transcriptional activity expressed in mouse Shh Light2 cells after 48 hrs by luciferase reporter gene assay | B | 5.3 | pIC50 | 5000 | nM | IC50 | Medchemcomm (2016) 7: 2328-2331 |
ChEMBL data shown on this page come from version 34:
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]