Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.57 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.45 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.45 |
| ▸ | FCER2 | P06734 | 1/20 | 0.45 |
| ▸ | ACE | P12821 | 4/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | MME | P08473 | 7/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CPA1 | P15085 | 2/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ECE1 | P42892 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7408168 | 1.00 | PIN1 (0.57) | PIN1PSMB5PSMB8FCER2ACE | |
| SCHEMBL7408164 | 1.00 | PIN1 (0.57) | PIN1PSMB5PSMB8FCER2ACE | |
| SCHEMBL7405258 | 0.85 | PIN1 (0.53) | PIN1PSMB5PSMB8FCER2ACE | |
| SCHEMBL7405261 | 0.85 | PIN1 (0.53) | PIN1PSMB5PSMB8FCER2ACE | |
| SCHEMBL7411428 | 0.79 | ACE (0.61) | PIN1ACEMMECPA1ACE2 | |
| SCHEMBL7411430 | 0.79 | ACE (0.61) | PIN1ACEMMECPA1ACE2 | |
| SCHEMBL7405095 | 0.79 | MME (0.61) | ACEMMECPA1ACE2ECE1 | |
| SCHEMBL7408172 | 0.76 | HRH4 (0.45) | ACEHRH4MMEMEN1KMT2A | |
| SCHEMBL8579944 | 0.74 | PIN1 (0.60) | PIN1PSMB5PSMB8FCER2ACE | |
| SCHEMBL2628545 | 0.74 | PIN1 (0.60) | PIN1PSMB5PSMB8FCER2ACE |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5414013-A | Enzyme inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1995-05-09 | — | — | US | disclosed |
| US-5414017-A | Cardiovascular agents | E. R. SQUIBB & SONS, INC. (US) | 1995-05-09 | — | — | US | disclosed |
| EP-0449523-B1 | Mercapto- or acylthio-trifluoromethyl amide derivatives and their use | SQUIBB & SONS INC (US) | 1994-08-17 | — | — | EP | disclosed |
| US-5223516-A | Endopeptidase inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1993-06-29 | — | — | US | disclosed |
| EP-0449523-A1 | Mercapto- or acylthio-trifluoromethyl amide derivatives and their use | E.R. SQUIBB & SONS, INC. (US) | 1991-10-02 | — | — | EP | disclosed |