Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.44 |
| ▸ | LDHA | P00338 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10881714 | 0.77 | CYP51A1 (0.51) | KDM4EALDH1A1GLAALOX15ALOX12 | |
| SCHEMBL9847015 | 0.74 | SLC6A2 (0.43) | ROCK2 | |
| SCHEMBL7039235 | 0.72 | CYP2D6 (0.41) | CA2 | |
| SCHEMBL11017873 | 0.71 | ACHE (0.47) | KDM4EALDH1A1ALOX15ALOX12LDHA | |
| SCHEMBL16973682 | 0.70 | ALOX15 (0.64) | KDM4EALDH1A1ALOX15ALOX12LDHA | |
| SCHEMBL31545634 | 0.70 | LDHA (0.59) | KDM4EALOX15ALOX12LDHACA2 | |
| SCHEMBL31545527 | 0.70 | LDHA (0.59) | KDM4EALOX15ALOX12LDHACA2 | |
| SCHEMBL266195 | 0.70 | LDHA (0.59) | KDM4EALOX15ALOX12LDHACA2 | |
| SCHEMBL3371646 | 0.70 | LDHA (0.59) | KDM4EALOX15ALOX12LDHACA2 | |
| SCHEMBL2564908 | 0.70 | LDHA (0.59) | KDM4EALOX15ALOX12LDHACA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0435222-A2 | Aminopyridinylmethanols and aminomethylpyridinamines and related compounds, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-07-03 | — | — | EP | disclosed |