Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | RBBP9 | O75884 | 5/20 | 0.41 |
| ▸ | CASP3 | P42574 | 3/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 3/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 3/20 | 0.40 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.40 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | FBP1 | P09467 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11254334 | 0.88 | ALDH1A1 (0.59) | ALDH1A1PLA2G4ACES1TSHRNOS1 | |
| SCHEMBL5609781 | 0.86 | ALDH1A1 (0.57) | ALDH1A1PLA2G4ACES1TSHRNOS1 | |
| SCHEMBL5609136 | 0.86 | ALDH1A1 (0.69) | ALDH1A1PLA2G4ACES1TSHRNOS1 | |
| SCHEMBL175249 | 0.84 | ALDH1A1 (0.67) | ALDH1A1PLA2G4ACES1TSHRNOS1 | |
| SCHEMBL12801063 | 0.83 | ALDH1A1 (0.64) | ALDH1A1PLA2G4ACES1RBBP9CASP3 | |
| Hydrochloric Acid SCHEMBL27980177 | 0.82 | ALDH1A1 (0.64) | ALDH1A1PLA2G4ACES1TSHRNOS1 | |
| SCHEMBL121301 | 0.82 | — | — | |
| SCHEMBL2170448 | 0.82 | — | — | |
| SCHEMBL10831806 | 0.81 | ALDH1A1 (0.52) | ALDH1A1PLA2G4ACES1TSHRNOS1 | |
| SCHEMBL8973785 | 0.81 | ALDH1A1 (0.52) | ALDH1A1PLA2G4ACES1TSHRNOS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104870429-A | Benzofuran derivative, preparation method therefor, and medical application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2015-08-26 | — | — | CN | claimed |
| CN-104870429-A | Benzofuran derivative, preparation method therefor, and medical application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2015-08-26 | — | — | CN | disclosed |