Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 8/20 | 0.63 |
| ▸ | CNR2 | P34972 | 9/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 7/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9080571 | 0.89 | TYMS (0.79) | TYMSALDH1A1KDM4EHTTHPGD | |
| SCHEMBL9702076 | 0.78 | TYMS (0.75) | TYMSALDH1A1KDM4EHTTHPGD | |
| SCHEMBL9080093 | 0.77 | TYMS (1.00) | TYMSALDH1A1KDM4EHTTHPGD | |
| SCHEMBL9508016 | 0.74 | TYMS (0.58) | TYMSCNR2CNR1 | |
| SCHEMBL9504724 | 0.73 | TYMS (0.52) | TYMSCNR2CNR1 | |
| SCHEMBL9506760 | 0.67 | TYMS (0.58) | TYMSCNR2CNR1 | |
| SCHEMBL7285017 | 0.64 | KDM4E (0.54) | ALDH1A1KDM4EHTTHPGDCASP1 | |
| SCHEMBL9704001 | 0.63 | TYMS (0.62) | TYMSALDH1A1KDM4EHTTHPGD | |
| SCHEMBL9508011 | 0.63 | TYMS (0.73) | TYMS | |
| SCHEMBL9508662 | 0.62 | TYMS (0.59) | TYMSALDH1A1LMNAMEN1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0550566-A1 | ANTIPROLIFERATIVE SUBSTITUTED NAPHTHALENE COMPOUNDS | AGOURON PHARMACEUTICALS (US) | 1993-07-14 | — | — | EP | disclosed |
| WO-1992005153-A1 | ANTIPROLIFERATIVE SUBSTITUTED NAPHTHALENE COMPOUNDS | AGOURON PHARMACEUTICALS, INC. (US) | 1992-04-02 | — | — | WO | disclosed |