Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9745246 | 1.00 | ALDH1A1 (0.43) | ALDH1A1BRD4MMP2ANPEPTHRB | |
| SCHEMBL9745048 | 1.00 | ALDH1A1 (0.43) | ALDH1A1BRD4MMP2ANPEPTHRB | |
| SCHEMBL9745052 | 1.00 | ALDH1A1 (0.43) | ALDH1A1BRD4MMP2ANPEPTHRB | |
| SCHEMBL9745059 | 1.00 | ALDH1A1 (0.43) | ALDH1A1BRD4MMP2ANPEPTHRB | |
| SCHEMBL2372196 | 0.87 | BRD4 (0.44) | ALDH1A1BRD4MMP2ANPEPCYP1A2 | |
| SCHEMBL3048242 | 0.87 | BRD4 (0.44) | ALDH1A1BRD4MMP2ANPEPCYP1A2 | |
| SCHEMBL15684230 | 0.87 | BRD4 (0.44) | ALDH1A1BRD4MMP2ANPEPCYP1A2 | |
| SCHEMBL7858138 | 0.87 | BRD4 (0.44) | ALDH1A1BRD4MMP2ANPEPCYP1A2 | |
| SCHEMBL994649 | 0.87 | BRD4 (0.44) | ALDH1A1BRD4MMP2ANPEPCYP1A2 | |
| SCHEMBL11268014 | 0.85 | ALDH1A1 (0.44) | ALDH1A1BRD4MMP2ANPEPCYP1A2 |
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-5151497-A | Central nervous system disorders, antidepressants, epilepsy and cognition activators | JAPAN TOBACCO INC. (JP) | 1992-09-29 | — | — | US | disclosed |