Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CFTR | P13569 | 2/20 | 0.40 |
| ▸ | GAK | O14976 | 1/20 | 0.39 |
| ▸ | STK16 | O75716 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | AXL | P30530 | 1/20 | 0.39 |
| ▸ | NEK2 | P51955 | 1/20 | 0.39 |
| ▸ | STK3 | Q13188 | 1/20 | 0.39 |
| ▸ | STK11 | Q15831 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.39 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.39 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7292041 | 0.83 | KDM4E (0.51) | LMNACYP1A2CYP3A4ALDH1A1MAPT | |
| SCHEMBL4591354 | 0.79 | CFTR (0.59) | LMNACYP1A2CYP3A4CFTRGAK | |
| Water SCHEMBL7302779 | 0.79 | CFTR (0.59) | LMNACYP1A2CYP3A4CFTRGAK | |
| SCHEMBL7284179 | 0.78 | GLA (0.42) | CYP1A2ALDH1A1AAK1BMP2KRAB9A | |
| Hydrochloric Acid SCHEMBL7298103 | 0.77 | ALDH1A1 (0.48) | LMNACYP1A2CYP3A4ALDH1A1MAPT | |
| SCHEMBL7292620 | 0.77 | KDM4E (0.50) | LMNACYP1A2CYP3A4ALDH1A1MAPT | |
| SCHEMBL7283041 | 0.75 | CLK4 (0.39) | CYP3A4ALDH1A1AXLAAK1KMT2A | |
| SCHEMBL7282598 | 0.75 | KDM4E (0.44) | LMNACYP1A2CYP3A4ALDH1A1MAPT | |
| SCHEMBL7284472 | 0.73 | L3MBTL1 (0.51) | LMNACYP1A2CYP3A4ALDH1A1MAPT | |
| SCHEMBL11238008 | 0.73 | GSK3A (0.45) | LMNACYP1A2ALDH1A1KMT2A |
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-0200024-B1 | 3-CYANO-PYRIDINES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE | ARZNEIMITTELWERK DRESDEN GmbH (DE) | 1992-07-01 | — | — | EP | disclosed |
| EP-0200024-A2 | 3-Cyano-pyridines, process for their preparation and their pharmaceutical use | ARZNEIMITTELWERK DRESDEN GmbH (DE) | 1986-11-05 | — | — | EP | disclosed |