Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 3/20 | 0.51 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19680573 | 0.90 | ALOX15 (0.51) | ALOX15NFE2L2ALDH1A1ATMTDP1 | |
| SCHEMBL17861079 | 0.90 | ALOX15 (0.51) | ALOX15NFE2L2ALDH1A1ATMTDP1 | |
| SCHEMBL13754147 | 0.86 | ALOX15 (0.48) | ALOX15NFE2L2ALDH1A1TDP1MAPT | |
| SCHEMBL13754145 | 0.86 | ALOX15 (0.45) | ALOX15NFE2L2ALDH1A1TDP1KDM4E | |
| SCHEMBL585939 | 0.81 | ALOX15 (0.61) | ALOX15NFE2L2ALDH1A1TDP1MAPK1 | |
| SCHEMBL5605059 | 0.81 | ALOX15 (0.61) | ALOX15NFE2L2ALDH1A1TDP1MAPK1 | |
| SCHEMBL5605056 | 0.81 | ALOX15 (0.61) | ALOX15NFE2L2ALDH1A1TDP1MAPK1 | |
| SCHEMBL4450364 | 0.81 | TP53 (0.47) | ALOX15TSHR | |
| SCHEMBL13754156 | 0.81 | TP53 (0.47) | ALOX15TSHR | |
| SCHEMBL6560967 | 0.79 | ALOX15 (0.58) | ALOX15NFE2L2ALDH1A1ATMTDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7572938-B2 | Precursors for ketones and aldehydes | GIVAUDAN SA (CH) | 2009-08-11 | — | — | US | disclosed |
| US-7572938-B2 | Precursors for ketones and aldehydes | GIVAUDAN SA (CH) | 2009-08-11 | — | — | US | disclosed |