Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.50 |
| ▸ | PTGES | O14684 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.50 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5014099 | 0.83 | CYP3A4 (0.56) | CYP3A4CYP2C9SMN1; SMN2RECQLKDM4E | |
| SCHEMBL372386 | 0.83 | CYP1A2 (0.51) | CYP3A4CYP2C9CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL11162670 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2C9ALOX5PTGESPPARG | |
| SCHEMBL688557 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2C9ALOX5PTGESPPARG | |
| SCHEMBL11312429 | 0.78 | CYP3A4 (0.50) | CYP3A4CYP2C9ALOX5PTGESPPARG | |
| SCHEMBL5698377 | 0.77 | CYP3A4 (0.61) | CYP3A4CYP2C9SMN1; SMN2RAB9ARECQL | |
| SCHEMBL3793616 | 0.77 | CYP3A4 (0.61) | CYP3A4CYP2C9CYP2C19RECQLTSHR | |
| SCHEMBL7699017 | 0.76 | USP2 (0.44) | CYP3A4CYP2C9ALOX5PTGESPPARG | |
| SCHEMBL27812598 | 0.76 | CYP3A4 (0.56) | CYP3A4CYP2C9ALOX5PTGESPPARG | |
| SCHEMBL27812605 | 0.76 | CYP3A4 (0.56) | CYP3A4CYP2C9ALOX5PTGESPPARG |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110028641-A1 | Radiation Curable Compositions | CYTEC SURFACE SPECIALTIES, S.A. (BE) | 2011-02-03 | — | — | US | disclosed |