Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 12/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 3/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10586739 | 0.90 | PIN1 (0.59) | PIN1CA2 | |
| SCHEMBL10586736 | 0.90 | PIN1 (0.59) | PIN1CA2 | |
| SCHEMBL18064448 | 0.89 | PIN1 (0.46) | PIN1CA2 | |
| SCHEMBL16576436 | 0.89 | PIN1 (0.46) | PIN1CA2 | |
| SCHEMBL5717643 | 0.86 | HPGDS (0.46) | ROCK2ROCK1HPGDS | |
| SCHEMBL16576433 | 0.83 | PIN1 (0.43) | PIN1 | |
| SCHEMBL12459907 | 0.81 | HPGDS (0.39) | ROCK2ROCK1HPGDSCA2 | |
| SCHEMBL9242008 | 0.80 | NLN (0.41) | PIN1 | |
| SCHEMBL8515469 | 0.79 | PIN1 (0.39) | PIN1 | |
| SCHEMBL24433825 | 0.78 | PSMB5 (0.41) | — |
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-4994477-A | Hypotensive agents | ABBOTT LABORATORIES (US) | 1991-02-19 | — | — | US | disclosed |