Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10914146 | 0.89 | LDHA (0.36) | LDHACYP2C9CYP2C19HTTPDE7A | |
| SCHEMBL10919048 | 0.84 | LDHA (0.43) | LDHATDP1TRPA1KDM4ECYP1A2 | |
| SCHEMBL11008233 | 0.84 | LDHA (0.49) | LDHAKDM4ECYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10926337 | 0.79 | LDHA (0.40) | LDHATDP1TRPA1KDM4ECYP1A2 | |
| SCHEMBL10921169 | 0.76 | LDHA (0.38) | LDHAKDM4ECYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10914742 | 0.76 | HRH2 (0.34) | TDP1KDM4ECYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10913659 | 0.72 | LDHA (0.39) | LDHATDP1KDM4ECYP1A2CYP2C9 | |
| SCHEMBL10923317 | 0.71 | ALDH1A1 (0.36) | TDP1CYP1A2CYP2C19ALDH1A1HPGD | |
| SCHEMBL10910590 | 0.70 | LDHA (0.38) | LDHATRPA1CYP1A2ALDH1A1CACNA1C | |
| SCHEMBL10922655 | 0.69 | LDHA (0.37) | LDHACYP1A2CYP2C9CYP2C19ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0088938-B1 | USE OF PYRIDINE COMPOUNDS FOR THE MANUFACTURE OF MEDICAMENTS WITH AN ANTIHYPOXEMIA AND ISCHEMIA-PROTECTIVE ACTIVITY | BAYER AG (DE) | 1986-04-30 | — | — | EP | disclosed |
| EP-0088938-A1 | Use of pyridine compounds for the manufacture of medicaments with an antihypoxemia and ischemia-protective activity | BAYER AG (DE) | 1983-09-21 | — | — | EP | disclosed |