Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | USP5 | P45974 | 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 | |
|---|---|---|---|---|
| SCHEMBL104124 | 0.83 | TYR (0.58) | TYRHTTIDO1NOTUMMGLL | |
| SCHEMBL1764658 | 0.83 | ESR1 (0.32) | LMNACYP2C9CYP2D6TRPA1PTGS1 | |
| SCHEMBL5695686 | 0.81 | TYR (0.46) | TYRHTTIDO1NOTUMMGLL | |
| Hydrochloric Acid SCHEMBL28212819 | 0.79 | TYR (0.55) | TYRHTTIDO1MGLLLMNA | |
| SCHEMBL6203905 | 0.79 | TYR (0.55) | TYRHTTIDO1NOTUMMGLL | |
| SCHEMBL27706878 | 0.79 | TYR (0.55) | TYRHTTIDO1NOTUMMGLL | |
| Ammonia Solution, Strong SCHEMBL7550588 | 0.79 | TYR (0.55) | TYRHTTIDO1NOTUMMGLL | |
| Water SCHEMBL11726962 | 0.79 | TYR (0.55) | TYRHTTIDO1NOTUMMGLL | |
| Water SCHEMBL29278796 | 0.79 | TYR (0.55) | TYRHTTIDO1NOTUMMGLL | |
| SCHEMBL28912214 | 0.79 | TYR (0.55) | TYRHTTIDO1NOTUMMGLL |
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 |
|---|---|---|---|---|---|---|---|
| EP-0041672-B1 | PROCESS FOR THE PREPARATION OF AROMATIC ALDEHYDES | BAYER AG (DE) | 1983-09-28 | — | — | EP | disclosed |
| EP-0041672-A1 | Process for the preparation of aromatic aldehydes | BAYER AG (DE) | 1981-12-16 | — | — | EP | disclosed |