Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2687511 | 0.87 | KDM4E (0.45) | KDM4ECASP6GABRA1GABRB2ALOX5 | |
| SCHEMBL9812457 | 0.81 | KDM4E (0.57) | KDM4ECASP6CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL10400341 | 0.79 | CYP1A2 (0.50) | KDM4EGABRA1GABRB2CYP1A2CYP2C9 | |
| SCHEMBL11369315 | 0.77 | GABRA1 (0.42) | KDM4EGABRA1GABRB2ALOX5XDH | |
| SCHEMBL3806192 | 0.77 | XDH (0.47) | KDM4EGABRA1GABRB2ALOX5CYP1A2 | |
| SCHEMBL15758050 | 0.76 | GAA (0.43) | KDM4EGABRA1GABRB2ALOX5MEN1 | |
| SCHEMBL14742304 | 0.76 | GABRA1 (0.39) | KDM4EGABRA1GABRB2ALOX5CYP1A2 | |
| SCHEMBL737479 | 0.76 | HSD17B10 (0.52) | KDM4ECASP6CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL10048531 | 0.76 | MGAM (0.50) | KDM4EGABRA1GABRB2ALOX5MEN1 | |
| SCHEMBL2461750 | 0.74 | XDH (0.48) | KDM4EGABRA1GABRB2ALOX5CYP3A4 |
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-5374638-A | Cardiovascular disorders, hypotensive agents | MERCK & CO., INC. (US) | 1994-12-20 | — | — | US | disclosed |