Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAX8 | Q06710 | 1/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.50 |
| ▸ | PKM | P14618 | 4/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | UBE2D3 | P61077 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4067886 | 0.85 | PAX8 (0.59) | PAX8PTGS2PKMNLRP3CYP19A1 | |
| SCHEMBL4061486 | 0.81 | PAX8 (0.54) | PAX8PTGS2PKMNLRP3 | |
| SCHEMBL4060418 | 0.79 | PAX8 (0.52) | PAX8PTGS2PKMNLRP3 | |
| Coronopilin SCHEMBL8422737 | 0.76 | PAX8 (1.00) | PAX8PTGS2PKMNLRP3CYP19A1 | |
| Parthenin SCHEMBL382003 | 0.72 | PAX8 (0.58) | PAX8PTGS2PKMNLRP3MAPT | |
| Hymenin SCHEMBL29711376 | 0.72 | PAX8 (0.58) | PAX8PTGS2PKMNLRP3MAPT | |
| Hymenin SCHEMBL11892893 | 0.72 | PAX8 (0.58) | PAX8PTGS2PKMNLRP3MAPT | |
| Hymenin SCHEMBL12355327 | 0.72 | PAX8 (0.58) | PAX8PTGS2PKMNLRP3MAPT | |
| SCHEMBL4058769 | 0.70 | PAX8 (0.55) | PAX8PTGS2PKMNLRP3MAPT | |
| SCHEMBL4060824 | 0.67 | PAX8 (0.51) | PAX8PTGS2PKMNLRP3UBE2D3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009122447-A1 | SEMI-SYNTHETIC SESQUITERPENE LACTONE PARTHENIN COMPOUND USEFUL FOR CYTOTOXICITY AGAINST CANCER CELL LINES AND ANTICANDER AGENT | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-10-08 | — | — | WO | claimed |
| WO-2009122447-A1 | SEMI-SYNTHETIC SESQUITERPENE LACTONE PARTHENIN COMPOUND USEFUL FOR CYTOTOXICITY AGAINST CANCER CELL LINES AND ANTICANDER AGENT | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-10-08 | — | — | WO | disclosed |