Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | ACVR1 | Q04771 | 3/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | NMT1 | P30419 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 2/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.34 |
| ▸ | INCENP | Q9NQS7 | 2/20 | 0.34 |
| ▸ | TPX2 | Q9ULW0 | 2/20 | 0.34 |
| ▸ | LSS | P48449 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8950322 | 0.81 | DGAT1 (0.41) | HRH3TAAR1DGAT1ADRA1DADRA1A | |
| SCHEMBL8997487 | 0.80 | HRH3 (0.52) | HRH3TAAR1MAP4K4ACVR1BRD4 | |
| SCHEMBL24185681 | 0.76 | DGAT1 (0.41) | DGAT1ADRA1DADRA1APIK3CDPIK3CA | |
| SCHEMBL8950312 | 0.75 | PIK3CA (0.43) | DGAT1ADRA1DADRA1AALDH1A1PIK3CD | |
| SCHEMBL8950122 | 0.74 | TDP1 (0.42) | DGAT1ADRA1DADRA1AALDH1A1PIK3CD | |
| SCHEMBL12679031 | 0.68 | HRH3 (1.00) | HRH3TAAR1BRD4BRD9ALDH1A1 | |
| SCHEMBL8950490 | 0.67 | ADRA1D (0.36) | DGAT1ADRA1DADRA1APIK3CDPIK3CA | |
| SCHEMBL8950114 | 0.67 | ADRA1D (0.36) | DGAT1ADRA1DADRA1APIK3CDPIK3CA | |
| SCHEMBL659509 | 0.65 | HRH3 (0.82) | HRH3TAAR1BRD4BRD9ALDH1A1 | |
| SCHEMBL260357 | 0.65 | HRH3 (0.81) | HRH3TAAR1BRD4BRD9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8188085-B2 | Antifungal agents | MERCK SHARP & DOHME CORP. (US) | 2012-05-29 | — | — | US | disclosed |
| US-20100113439-A1 | Antifungal agents | MERCK & CO., INC. (US) | 2010-05-06 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100113439-A1 | Antifungal agents | GMDS, GBA3, UGGT1 | HRH3 2616/4885TAAR1 4765/4885MAP4K4 2380/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.