Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.61 |
| ▸ | CA2 | P00918 | 4/20 | 0.61 |
| ▸ | CA9 | Q16790 | 4/20 | 0.61 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.61 |
| ▸ | CA1 | P00915 | 3/20 | 0.61 |
| ▸ | CA3 | P07451 | 3/20 | 0.61 |
| ▸ | CA4 | P22748 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 6/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | BAX | Q07812 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Phenol SCHEMBL11025046 | 0.94 | CA12 (0.69) | CA12CA2CA9CA14CA1 | |
| Phenol SCHEMBL3264490 | 0.94 | CA12 (0.69) | CA12CA2CA9CA14CA1 | |
| Phenol SCHEMBL3281438 | 0.89 | CA12 (0.61) | CA12CA2CA9CA14CA1 | |
| Phenol SCHEMBL8596544 | 0.89 | CA12 (0.61) | CA12CA2CA9CA14CA1 | |
| Phenol SCHEMBL11092368 | 0.85 | — | — | |
| Phenol SCHEMBL6131159 | 0.83 | TDP1 (0.61) | CA12CA2CA9CA14CA1 | |
| Phenol SCHEMBL134290 | 0.82 | — | — | |
| Phenol SCHEMBL11877136 | 0.82 | — | — | |
| Phenol SCHEMBL9445030 | 0.82 | CA12 (0.92) | CA12CA2CA9CA14CA1 | |
| Phenol SCHEMBL1702878 | 0.82 | CA12 (0.92) | CA12CA2CA9CA14CA1 |
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-0618281-B1 | High temperature corrosion inhibitor | BETZ EUROP INC (US) | 1998-01-14 | — | — | EP | claimed |