Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT2B | Q92831 | 12/20 | 0.77 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | RGS4 | P49798 | 2/20 | 0.33 |
| ▸ | RGS8 | P57771 | 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 | |
|---|---|---|---|---|
| SCHEMBL929340 | 0.89 | KAT2B (0.90) | KAT2BCA12CA1CA9GSK3B | |
| SCHEMBL11193788 | 0.85 | KAT2B (0.97) | KAT2BCA12CA1CA9ALDH1A1 | |
| SCHEMBL1851730 | 0.85 | KAT2B (0.97) | KAT2BCA12CA1CA9ALDH1A1 | |
| SCHEMBL9565234 | 0.85 | KAT2B (0.97) | KAT2BCA12CA1CA9ALDH1A1 | |
| SCHEMBL1535928 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL11713957 | 0.83 | KAT2B (0.90) | KAT2BCA12CA1CA9ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11713961 | 0.83 | KAT2B (0.90) | KAT2BCA12CA1CA9ALDH1A1 | |
| SCHEMBL9565202 | 0.82 | KAT2B (0.79) | KAT2BCA12CA1CA9ALDH1A1 | |
| SCHEMBL9234887 | 0.80 | KAT2B (0.61) | KAT2BCA12CA1CA9 | |
| SCHEMBL8579476 | 0.78 | KAT2B (0.80) | KAT2BCA12CA1CA9ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4396413-A | BACTERICIDES, FUNGICIDES, ALGICIDES | ROHM AND HAAS COMPANY (US) | 1983-08-02 | — | — | US | disclosed |
| US-4241214-A | BACTERICIDE, FUNGICIDE AND ALGAECIDE | ROHM AND HAAS COMPANY (US) | 1980-12-23 | — | — | US | disclosed |
| US-4150026-A | BACTERICIDES, FUNGICIDES, ALGICIDES | ROHM AND HAAS COMPANY (US) | 1979-04-17 | — | — | US | disclosed |
| US-4062946-A | 3-ISOTHIAZOLONES | ROHM AND HAAS COMPANY (US) | 1977-12-13 | — | — | US | disclosed |