Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.65 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 2/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL4373563 | 0.84 | ALDH1A1 (0.67) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| SCHEMBL6747891 | 0.82 | ALDH1A1 (0.74) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| SCHEMBL2958562 | 0.80 | ALDH1A1 (0.92) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| Formaldehyde SCHEMBL28138834 | 0.80 | ALDH1A1 (0.92) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| Benzene SCHEMBL28038982 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| SCHEMBL30196067 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| SCHEMBL44392 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| SCHEMBL7821087 | 0.78 | ALDH1A1 (0.74) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| SCHEMBL11792031 | 0.77 | ALDH1A1 (0.88) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 | |
| Methane SCHEMBL2186810 | 0.77 | ALDH1A1 (0.96) | ALDH1A1TDP1ADAMTS4PTPN1S100A4 |
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-0632017-B1 | N-phenyl-2-cyano-3-hydroxy propenamides, their tautomeres and salts, their use as medicaments and compositions containing them | HOECHST MARION ROUSSEL INC (FR) | 1998-05-06 | — | — | EP | disclosed |
| US-5416112-A | Antiinflammatory agents | ROUSSEL UCLAF (FR) | 1995-05-16 | — | — | US | disclosed |
| US-5385931-A | Multistage formation of sulfonamides by reaction of esters and acyl halides, nitriding, reduction and sulfonylation to form cardiovascular compounds | PIERRE FABRE MEDICAMENT (FR) | 1995-01-31 | — | — | US | disclosed |
| EP-0632017-A1 | N-phenyl-2-cyano-3-hydroxy propenamides, their tautomeres and salts, their use as medicaments and compositions containing them | ROUSSEL UCLAF (FR) | 1995-01-04 | — | — | EP | disclosed |