Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | DRD4 | P21917 | 3/20 | 0.36 |
| ▸ | DRD3 | P35462 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MIF | P14174 | 2/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1779841 | 0.85 | HDAC1 (0.42) | EGFRHDAC1DRD2DRD4DRD3 | |
| SCHEMBL20341902 | 0.78 | TLR7 (0.41) | EGFRDRD2DRD4DRD3MIF | |
| SCHEMBL7510103 | 0.76 | HPGD (0.33) | ALDH1A1MAPTGAATDP1L3MBTL1 | |
| SCHEMBL3070035 | 0.73 | HPGD (0.46) | HDAC1ALDH1A1MAPTGAAL3MBTL1 | |
| SCHEMBL7521287 | 0.72 | MMP3 (0.40) | EGFRHDAC1L3MBTL1KCNH2AGTR1 | |
| SCHEMBL8878511 | 0.71 | AGTR1 (0.34) | MAPTGAAL3MBTL1MEN1KMT2A | |
| SCHEMBL8878630 | 0.71 | EGFR (0.48) | EGFRALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL7372202 | 0.71 | MIF (0.64) | EGFRHDAC1ALDH1A1MAPTMEN1 | |
| SCHEMBL8889398 | 0.71 | EGFR (0.43) | EGFRHDAC1GAAKMT2AADORA2A | |
| SCHEMBL7507671 | 0.70 | EGFR (0.45) | EGFRHDAC1ALDH1A1MAPTMEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0556080-B1 | Bicyclic pyridine derivatives, process for their preparation, intermediates, their use as medicaments and pharmaceutical compositions containing them | AVENTIS PHARMA SA (FR) | 2002-05-08 | — | — | EP | disclosed |
| US-5691347-A | ANGIOTENSIN II INHIBITORS AND VASOCONSTRICTION | ROUSSEL UCLAF (FR) | 1997-11-25 | — | — | US | disclosed |
| US-5420138-A | Antivasoconstriction compounds and cardiovascular disorders | ROUSSEL-UCLAF (FR) | 1995-05-30 | — | — | US | disclosed |
| EP-0556080-A1 | Bicyclic pyridine derivatives, process for their preparation, intermediates, their use as medicaments and pharmaceutical compositions containing them | ROUSSEL UCLAF (FR) | 1993-08-18 | — | — | EP | disclosed |