Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | APEX1 | P27695 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12266517 | 0.81 | LMNA (0.60) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| SCHEMBL1315786 | 0.80 | CYP1A2 (0.59) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| SCHEMBL30892029 | 0.80 | CYP1A2 (0.59) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| Hydrochloric Acid SCHEMBL6999839 | 0.78 | CYP1A2 (0.56) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| SCHEMBL5663372 | 0.77 | MAPT (0.53) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| SCHEMBL1536453 | 0.77 | CYP2A6 (0.54) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| SCHEMBL2380637 | 0.77 | CYP3A4 (0.54) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| SCHEMBL31339851 | 0.77 | CYP3A4 (0.54) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| SCHEMBL1315767 | 0.77 | MAPT (0.53) | LMNAMAPTCYP3A4MAPK1APEX1 | |
| SCHEMBL1134001 | 0.77 | MAPT (0.53) | LMNAMAPTCYP3A4MAPK1APEX1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012002577-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | 富士フイルム株式会社 (JP) | 2012-01-05 | — | — | WO | disclosed |