Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GSR | P00390 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | INCENP | Q9NQS7 | 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 | |
|---|---|---|---|---|
| SCHEMBL23341814 | 0.82 | GSR (0.58) | ALDH1A1TSHRTDP1TP53CYP3A4 | |
| SCHEMBL9689314 | 0.82 | ALDH1A1 (0.58) | ALDH1A1TSHRTDP1TP53CYP3A4 | |
| SCHEMBL14547436 | 0.80 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1HRH3GAA | |
| SCHEMBL16104735 | 0.76 | ALDH1A1 (0.41) | ALDH1A1TSHRTDP1HRH3GAA | |
| SCHEMBL1716900 | 0.76 | ALDH1A1 (0.55) | ALDH1A1TSHRTDP1HRH3GAA | |
| SCHEMBL25479653 | 0.76 | ALOX15 (0.55) | ALDH1A1TSHRTDP1HRH3GAA | |
| SCHEMBL2528801 | 0.76 | ALDH1A1 (0.55) | ALDH1A1TSHRTDP1HRH3GAA | |
| SCHEMBL14938637 | 0.76 | SKP2 (0.53) | ALDH1A1TSHRTDP1CYP3A4HRH3 | |
| SCHEMBL4643735 | 0.75 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1HRH3GAA | |
| SCHEMBL2153739 | 0.74 | ALDH1A1 (0.55) | ALDH1A1TSHRTDP1TP53CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-1045346-A | — | — | None | — | — | JP | disclosed |
| US-5117061-A | Process of preparing substituted anilines | ETHYL CORPORATION (US) | 1992-05-26 | — | — | US | disclosed |
| JP-S6445346-A | PRODUCTION OF METHYLANILINES | DAICEL CHEM | 1989-02-17 | — | — | JP | disclosed |