Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10352085 | 0.79 | ALDH1A1 (0.44) | ALDH1A1 | |
| SCHEMBL11392773 | 0.75 | USP2 (0.47) | USP2CYP3A4SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL17350204 | 0.71 | USP2 (0.44) | USP2CYP3A4SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL1976212 | 0.71 | — | — | |
| SCHEMBL6060157 | 0.70 | — | — | |
| SCHEMBL10900117 | 0.70 | USP2 (0.47) | USP2CYP3A4SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL1062616 | 0.69 | — | — | |
| SCHEMBL896257 | 0.69 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL3026296 | 0.68 | — | — | |
| SCHEMBL4274926 | 0.68 | — | — |
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-4177220-A | FROM VINYL ACETYLENE AND BUTADIENE | SHELL OIL COMPANY (US) | 1979-12-04 | — | — | US | disclosed |