Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19983185 | 0.75 | ALDH1A1 (0.40) | ALDH1A1TDP1CA2CYP3A4TSHR | |
| SCHEMBL28230080 | 0.74 | ALDH1A1 (0.43) | ALDH1A1TDP1CA2CYP3A4TSHR | |
| SCHEMBL2496090 | 0.71 | FDPS (0.42) | ALDH1A1TSHRLMNAMEN1KMT2A | |
| SCHEMBL516455 | 0.71 | FDPS (0.42) | ALDH1A1TSHRLMNAMEN1KMT2A | |
| SCHEMBL382576 | 0.71 | ALDH1A1 (0.62) | ALDH1A1TDP1CA2CYP3A4TSHR | |
| SCHEMBL82932 | 0.71 | — | — | |
| SCHEMBL16896971 | 0.70 | ALDH1A1 (0.54) | ALDH1A1TDP1CA2CYP3A4TSHR | |
| SCHEMBL979078 | 0.70 | ALDH1A1 (0.54) | ALDH1A1TDP1CA2CYP3A4TSHR | |
| SCHEMBL218869 | 0.70 | ALDH1A1 (0.54) | ALDH1A1TDP1CA2CYP3A4TSHR | |
| SCHEMBL16897049 | 0.70 | ALDH1A1 (0.54) | ALDH1A1TDP1CA2CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1661900-A1 | Olefin polymerization cocatalysts derived from group-15 cationic compounds and processes using them | ExxonMobil Chemical Patents Inc. (US) | 2006-05-31 | — | — | EP | disclosed |