Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.56 |
| ▸ | HPGDS | O60760 | 1/20 | 0.54 |
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | CDC25B | P30305 | 2/20 | 0.53 |
| ▸ | EP300 | Q09472 | 1/20 | 0.52 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | STAT6 | P42226 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.48 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL19244671 | 0.86 | CDC25B (0.56) | PLK1HPGDSIDO1CDC25BEP300 | |
| SCHEMBL9195639 | 0.86 | HTT (0.54) | PLK1HPGDSIDO1CDC25BEP300 | |
| SCHEMBL7803575 | 0.85 | HSD17B10 (0.58) | PLK1HPGDSIDO1CDC25BMAPT | |
| SCHEMBL30003241 | 0.85 | HSD17B10 (0.58) | PLK1HPGDSIDO1CDC25BMAPT | |
| SCHEMBL10381361 | 0.82 | HPGDS (0.54) | PLK1HPGDSIDO1CDC25BEP300 | |
| SCHEMBL419307 | 0.82 | IDO1 (0.73) | PLK1HPGDSIDO1CDC25BEP300 | |
| SCHEMBL29380721 | 0.82 | IDO1 (0.73) | PLK1HPGDSIDO1CDC25BEP300 | |
| SCHEMBL15302579 | 0.81 | PLK1 (0.50) | PLK1HPGDSIDO1CDC25BEP300 | |
| SCHEMBL16005349 | 0.81 | ELANE (0.54) | PLK1HPGDSIDO1CDC25BEP300 | |
| Guaiacol Carbonate SCHEMBL21541 | 0.80 | CA1 (0.62) | MAPTHPGDKMT2AALDH1A1HSD17B10 |
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-2852678-B1 | TRAPPING REAGENTS FOR REACTIVE METABOLITES SCREENING | BIOGEN MA INC (US) | 2017-08-23 | — | — | EP | disclosed |