Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KRAS | P01116 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28002137 | 0.98 | CES2 (0.37) | CES2CES1MEN1KMT2AALDH1A1 | |
| SCHEMBL27834496 | 0.97 | ALDH1A1 (0.41) | CES2CES1MEN1KMT2AALDH1A1 | |
| SCHEMBL5427708 | 0.81 | ALDH1A1 (0.44) | CES2CES1MEN1KMT2AALDH1A1 | |
| SCHEMBL27304277 | 0.80 | ALDH1A1 (0.53) | MEN1KMT2AALDH1A1KDM4ECYP1A2 | |
| SCHEMBL27452198 | 0.78 | ALDH1A1 (0.47) | MEN1KMT2AALDH1A1KDM4ECYP1A2 | |
| SCHEMBL28037612 | 0.76 | ALDH1A1 (0.37) | MEN1KMT2AALDH1A1KDM4ECYP1A2 | |
| SCHEMBL27661280 | 0.76 | ALDH1A1 (0.61) | MEN1KMT2AALDH1A1KDM4ECYP1A2 | |
| SCHEMBL3671771 | 0.75 | CYP1A2 (0.40) | CES2CES1MEN1KMT2AALDH1A1 | |
| SCHEMBL27810256 | 0.74 | ALDH1A1 (0.59) | MEN1KMT2AALDH1A1KDM4ECYP1A2 | |
| SCHEMBL28002136 | 0.74 | CYP1A2 (0.38) | CES2CES1MEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102124015-B | Silylethynyl pentacene compounds and compositions, and methods of making and using the same | 3M INNOVATIVE PROPERTIES CO | 2015-03-11 | — | — | CN | disclosed |