Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 5/20 | 0.45 |
| ▸ | TUBB | P07437 | 5/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 5/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 5/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 5/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 5/20 | 0.45 |
| ▸ | TUBB3 | Q13509 | 5/20 | 0.45 |
| ▸ | TUBB2A | Q13885 | 5/20 | 0.45 |
| ▸ | TUBB8 | Q3ZCM7 | 5/20 | 0.45 |
| ▸ | TUBA3E | Q6PEY2 | 5/20 | 0.45 |
| ▸ | TUBA1A | Q71U36 | 5/20 | 0.45 |
| ▸ | TUBA1C | Q9BQE3 | 5/20 | 0.45 |
| ▸ | TUBB6 | Q9BUF5 | 5/20 | 0.45 |
| ▸ | TUBB2B | Q9BVA1 | 5/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2272896 | 0.82 | PTGS2 (0.55) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| SCHEMBL28083679 | 0.81 | PTGS2 (0.53) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| SCHEMBL6845422 | 0.78 | PTGS2 (0.59) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| SCHEMBL7046945 | 0.76 | PTGS2 (0.57) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| SCHEMBL499116 | 0.74 | GAA (0.61) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| SCHEMBL4965033 | 0.74 | PTGS2 (0.55) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| SCHEMBL2307800 | 0.74 | PTGS2 (0.55) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| Hydrochloric Acid SCHEMBL4002124 | 0.73 | GAA (0.59) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| SCHEMBL2272890 | 0.73 | PTGS2 (0.53) | PTGS2HTR2AHTR2CHTR2BCYP3A4 | |
| SCHEMBL4240508 | 0.73 | PTGS2 (0.53) | PTGS2HTR2AHTR2CHTR2BCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4352928-A | ANTIINFLAMMATORY, HYPOGLYCEMIC, ANTICOAGULANT, ANOREXIGENIC, SEROTONIN EFFEC | MITSUBISHI YUKA PHARMACEUTICAL CO., LTD. (JP) | 1982-10-05 | — | — | US | disclosed |