Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 2/20 | 0.58 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
| ▸ | TYMS | P04818 | 2/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 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 | |
|---|---|---|---|---|
| SCHEMBL26638890 | 0.86 | TDP2 (0.58) | TDP2CES1BCHETGM2TYMS | |
| SCHEMBL29569174 | 0.80 | TDP2 (0.55) | TDP2CES1TGM2TYMSCASP3 | |
| SCHEMBL4891220 | 0.80 | TDP2 (0.55) | TDP2CES1TGM2TYMSCASP3 | |
| SCHEMBL10138376 | 0.80 | PBRM1 (0.59) | TDP2CES1TGM2TYMSPBRM1 | |
| SCHEMBL31695158 | 0.80 | PBRM1 (0.59) | TDP2CES1TGM2TYMSPBRM1 | |
| SCHEMBL23337130 | 0.79 | TDP2 (0.46) | TDP2CES1TGM2TYMSCASP3 | |
| SCHEMBL24773448 | 0.77 | ALDH1A1 (0.41) | CES1BCHEALDH1A1KDM4EHPGD | |
| SCHEMBL12500758 | 0.77 | MAOA (0.48) | TDP2CES1TGM2TYMSPBRM1 | |
| SCHEMBL3665755 | 0.77 | MAOA (0.53) | TDP2CES1TGM2TYMSPBRM1 | |
| SCHEMBL21547664 | 0.75 | TDP2 (0.51) | TDP2CES1BCHETGM2TYMS |
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-5869693-A | Benzocyclobutenones and polymers derived therefrom | CARLETON UNIVERSITY (CA) | 1999-02-09 | — | — | US | disclosed |