Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 9/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KDM6B | O15054 | 1/20 | 0.41 |
| ▸ | KDM4A | O75164 | 1/20 | 0.41 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.41 |
| ▸ | KDM3B | Q7LBC6 | 1/20 | 0.41 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.41 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.41 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL9292094 | 0.89 | ALDH1A1 (0.43) | TSHRCYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7885587 | 0.83 | ALDH1A1 (0.45) | CYP1A2CYP2C9CYP2C19KDM5BALDH1A1 | |
| SCHEMBL7889798 | 0.80 | KDM4E (0.48) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL9288631 | 0.78 | GPR84 (0.58) | GPR84SMN1; SMN2SCN9ASCN5AXDH | |
| SCHEMBL7309807 | 0.73 | ALDH1A1 (0.44) | GPR84SMN1; SMN2LMNAMAPK1NPSR1 | |
| SCHEMBL7885220 | 0.72 | ALDH1A1 (0.51) | LMNAMAPK1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1275935 | 0.70 | ALDH1A1 (0.46) | SMN1; SMN2LMNAMAPK1NPSR1TSHR | |
| SCHEMBL7309272 | 0.69 | ALDH1A1 (0.49) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7885491 | 0.69 | ALDH1A1 (0.49) | SMN1; SMN2LMNAMAPK1CYP1A2CYP2C9 | |
| SCHEMBL3205024 | 0.69 | ALDH1A1 (0.49) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 |
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-5329012-A | Bactericides, fungicides or antitumor agents | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1994-07-12 | — | — | US | disclosed |
| EP-0313724-A2 | Bis (acyloxymethyl) imidazole Derivative | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1989-05-03 | — | — | EP | disclosed |