Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRA | P16234 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | MET | P08581 | 4/20 | 0.39 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AXL | P30530 | 3/20 | 0.37 |
| ▸ | RET | P07949 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6293301 | 0.76 | HSPB1 (0.43) | KCNH2MRGPRX1HTR2AL3MBTL1ALDH1A1 | |
| SCHEMBL6149796 | 0.74 | ALDH1A1 (0.44) | TRPA1CYP3A4L3MBTL1ALDH1A1LMNA | |
| SCHEMBL17508484 | 0.73 | TRPA1 (0.42) | PDGFRAKDRTRPA1CYP1A2CYP3A4 | |
| SCHEMBL17524535 | 0.71 | TRPA1 (0.40) | PDGFRAKDRTRPA1CYP1A2CYP3A4 | |
| SCHEMBL3586415 | 0.71 | TRPA1 (0.37) | PDGFRAKDRTRPA1CYP1A2CYP3A4 | |
| SCHEMBL9343291 | 0.70 | TGFBR1 (0.44) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7470310 | 0.70 | MAOA (0.38) | PDGFRAKDRTRPA1CYP1A2CYP3A4 | |
| SCHEMBL17524357 | 0.69 | TRPA1 (0.50) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14285766 | 0.68 | RET (0.44) | PDGFRAKDRTRPA1CYP1A2CYP3A4 | |
| SCHEMBL7463159 | 0.68 | RET (0.44) | PDGFRAKDRTRPA1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5114955-A | Derivatives with pyridine as gastrointestinal disorders and antisecretory agents | HOECHST AKETIENGESELLSCHAFT (DE) | 1992-05-19 | — | — | US | disclosed |