Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
| ▸ | DPP4 | P27487 | 1/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19954317 | 1.00 | KCNH2 (0.52) | KCNH2HRH3DPP4HSD11B1CA12 | |
| SCHEMBL18086474 | 0.90 | NPC1 (0.52) | KCNH2HRH3DPP4NPC1TP53 | |
| SCHEMBL16311052 | 0.90 | DPP4 (0.45) | KCNH2HRH3DPP4ROCK2CYP3A4 | |
| SCHEMBL20124899 | 0.90 | NPC1 (0.52) | KCNH2HRH3DPP4NPC1TP53 | |
| SCHEMBL4905787 | 0.88 | DGAT1 (0.45) | KCNH2HRH3DPP4HSD11B1CA12 | |
| SCHEMBL14400988 | 0.83 | ACHE (0.55) | DPP4ROCK2CYP3A4ALDH1A1HRH2 | |
| SCHEMBL15045186 | 0.83 | KCNH2 (0.61) | KCNH2HRH3CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL21995059 | 0.82 | ROCK2 (0.54) | DPP4ROCK2CYP3A4ALDH1A1HRH2 | |
| Hydrochloric Acid SCHEMBL21995057 | 0.82 | ROCK2 (0.54) | DPP4ROCK2CYP3A4ALDH1A1HRH2 | |
| SCHEMBL21682556 | 0.81 | DPP4 (0.44) | DPP4ROCK2CYP3A4HRH2HRH1 |
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-3008045-B1 | ANTIBACTERIAL THIAZOLECARBOXYLIC ACIDS | ANTABIO SAS (FR) | 2018-05-09 | — | — | EP | disclosed |
| US-9914712-B2 | Antibacterial thiazolecarboxylic acids | ANTABIO SAS (FR) | 2018-03-13 | — | — | US | disclosed |