Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | REN | P00797 | 2/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL11431101 | 1.00 | KDM4E (0.54) | KDM4ESMN1; SMN2POLBNPSR1TSHR | |
| SCHEMBL11430017 | 1.00 | KDM4E (0.54) | KDM4ESMN1; SMN2POLBNPSR1TSHR | |
| SCHEMBL11429475 | 0.99 | KDM4E (0.52) | KDM4ESMN1; SMN2POLBNPSR1TSHR | |
| SCHEMBL11516951 | 0.86 | ACE (0.46) | KDM4ERENACE | |
| SCHEMBL11517034 | 0.85 | ACE (0.45) | KDM4ERENACE | |
| SCHEMBL18681285 | 0.84 | ACE (0.44) | KDM4ERENACE | |
| SCHEMBL11519144 | 0.84 | FKBP5 (0.44) | KDM4EPOLBRENACE | |
| SCHEMBL11431773 | 0.82 | ACE (0.61) | KDM4ERENACE | |
| SCHEMBL11429550 | 0.79 | NPSR1 (0.52) | POLBNPSR1TSHRRENACE | |
| Bromide SCHEMBL11441971 | 0.78 | KDM4E (0.61) | KDM4ESMN1; SMN2POLBNPSR1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4187216-A | ELASTASE INHIBITORS | HOFFMANN-LA ROCHE INC. (US) | 1980-02-05 | — | — | US | claimed |
| US-4187216-A | ELASTASE INHIBITORS | HOFFMANN-LA ROCHE INC. (US) | 1980-02-05 | — | — | US | disclosed |