Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.46 |
| ▸ | BCR | P11274 | 2/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 2/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6846547 | 0.86 | CYP1A1 (0.38) | ABL1BCRTDP1TUBB1CYP1A2 | |
| SCHEMBL15382566 | 0.81 | TDP1 (0.38) | ABL1BCRTDP1TUBB1CYP1A2 | |
| SCHEMBL12716646 | 0.79 | TUBB1 (0.43) | TDP1TUBB1CYP1A2CYP2D6CYP1A1 | |
| SCHEMBL12716657 | 0.79 | TUBB1 (0.39) | TDP1TUBB1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL12716654 | 0.78 | TUBB1 (0.55) | TDP1TUBB1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL490461 | 0.78 | TDP1 (0.68) | ALOX5TDP1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL490462 | 0.78 | TDP1 (0.68) | ALOX5TDP1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12707889 | 0.78 | TUBB1 (0.51) | TDP1TUBB1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL14567566 | 0.77 | TUBB1 (0.49) | ABL1BCRALOX5TDP1TUBB1 | |
| SCHEMBL15382583 | 0.76 | ABL1 (0.34) | ABL1BCRTDP1TUBB1CYP1A2 |
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-20040234811-A1 | Energy-transfer type light-emitting polymer based on poly(p-phenylene vinylene) and preparation thereof | CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCE (CN) | 2004-11-25 | — | — | US | disclosed |