Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 2/20 | 0.46 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.45 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.45 |
| ▸ | ITGAL | P20701 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11081514 | 0.81 | PDE10A (0.41) | CYP3A4ALDH1A1TSHRHPGDHSD17B10 | |
| SCHEMBL3483627 | 0.78 | ALDH1A1 (0.40) | ALDH1A1HPGDMAPTKMT2AMEN1 | |
| SCHEMBL11074664 | 0.78 | ALDH1A1 (0.49) | CA1CA2ALDH1A1TSHRHPGD | |
| SCHEMBL2924582 | 0.77 | THRB (0.39) | CYP3A4CA1CA2ALDH1A1TSHR | |
| SCHEMBL11325519 | 0.77 | APEX1 (0.37) | ALDH1A1TSHRHPGDTHRBMAPT | |
| SCHEMBL10824330 | 0.75 | IDO1 (0.47) | ALDH1A1TSHRHPGDHSD17B10MAPT | |
| SCHEMBL11074606 | 0.75 | PDE7A (0.51) | PDE7AALDH1A1HSD17B10MAPTKMT2A | |
| SCHEMBL10891104 | 0.74 | SLC6A4 (0.33) | ALDH1A1HPGDMAPTKMT2AMEN1 | |
| SCHEMBL6936444 | 0.73 | MAPT (0.36) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL30168144 | 0.72 | ITGB2 (0.47) | PDE7AITGB2ICAM1ITGALCYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4490540-A | FUNGICIDES, ANTITUMOR AGENTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1984-12-25 | — | — | US | disclosed |
| EP-0052905-B1 | NOVEL (2-ARYL-4-PHENYLTHIOALKYL-1,3-DIOXOLAN-2-YL-METHYL)AZOLE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1984-10-03 | — | — | EP | disclosed |
| EP-0052905-A1 | Novel (2-aryl-4-phenylthioalkyl-1,3-dioxolan-2-yl-methyl)azole derivatives | JANSSEN PHARMACEUTICA N.V. (BE) | 1982-06-02 | — | — | EP | disclosed |