Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30538382 | 1.00 | CA2 (0.44) | CA2ALDH1A1MAPK1CYP3A4TSHR | |
| SCHEMBL16908421 | 0.92 | CYP2C19 (0.42) | CA2ALDH1A1MAPK1CYP3A4TSHR | |
| SCHEMBL779884 | 0.86 | CA2 (0.37) | CA2ALDH1A1MAPK1CYP3A4TSHR | |
| SCHEMBL29829743 | 0.83 | CYP3A4 (0.45) | CA2ALDH1A1MAPK1CYP3A4TSHR | |
| SCHEMBL18602061 | 0.81 | CYP2C19 (0.44) | — | |
| SCHEMBL3360175 | 0.79 | CA2 (0.42) | CA2ALDH1A1MAPK1CYP3A4TSHR | |
| SCHEMBL4458916 | 0.79 | CA2 (0.34) | CA2ALDH1A1MAPK1CYP3A4TSHR | |
| SCHEMBL888012 | 0.76 | CA2 (0.42) | CA2ALDH1A1MAPK1CYP3A4TSHR | |
| SCHEMBL5519400 | 0.76 | CA2 (0.42) | CA2ALDH1A1MAPK1CYP3A4TSHR | |
| SCHEMBL2233956 | 0.76 | CA2 (0.39) | CA2ALDH1A1MAPK1CYP3A4TSHR |
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-0205403-B1 | PROCESS FOR THE MANUFACTURE OF CYCLOPROPYLAMINE | CIBA-GEIGY AG (CH) | 1989-08-30 | — | — | EP | disclosed |
| US-4590292-A | FROM GAMMA-BUTYROLACTONE | CIBA-GEIGY CORPORATION (US) | 1986-05-20 | — | — | US | disclosed |