Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 10/20 | 0.76 |
| ▸ | BRD2 | P25440 | 6/20 | 0.76 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.76 |
| ▸ | AR | P10275 | 1/20 | 0.56 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.54 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.51 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | BRD3 | Q15059 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.48 |
| ▸ | ERN1 | O75460 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14562258 | 0.81 | BRD4 (0.73) | BRD4BRD2CREBBPARATAD2 | |
| SCHEMBL17698684 | 0.81 | BRD4 (0.61) | BRD4BRD2CREBBPARNR3C2 | |
| SCHEMBL23386184 | 0.78 | FTO (0.66) | BRD4BRD2CREBBPARFTO | |
| SCHEMBL4262253 | 0.77 | PARP1 (0.60) | POLBERN1PARP1CYP3A4 | |
| SCHEMBL980536 | 0.76 | MAP4K4 (0.76) | BRD4BRD2CREBBPATAD2BRD3 | |
| SCHEMBL12487 | 0.76 | NPC1 (0.69) | BRD4BRD2CREBBPBRD3NPC1 | |
| Hydrochloric Acid SCHEMBL1016039 | 0.75 | MAP4K4 (0.73) | BRD4BRD2CREBBPATAD2BRD3 | |
| SCHEMBL30454185 | 0.75 | L3MBTL1 (0.68) | NPC1POLBRAB9APARP1 | |
| SCHEMBL326777 | 0.75 | L3MBTL1 (0.68) | NPC1POLBRAB9APARP1 | |
| SCHEMBL22775611 | 0.74 | BRD4 (0.60) | BRD4BRD2CREBBPHDAC1BRD3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |
| US-8642788-B2 | Activators of executioner procaspases 3, 6 and 7 | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2014-02-04 | — | — | US | disclosed |
| EP-2237784-A1 | ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 | The Regents of the University of California (US) | 2010-10-13 | — | — | EP | disclosed |
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | disclosed |
| WO-2009089508-A1 | ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2009-07-16 | — | — | WO | disclosed |