Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | MYLK | Q15746 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8914317 | 0.90 | CYP3A4 (0.46) | ALDH1A1KDM4EHSD17B10NPSR1MAPK1 | |
| SCHEMBL8913765 | 0.82 | F2 (0.49) | MAPK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8913812 | 0.81 | ROCK2 (0.51) | ALDH1A1KDM4EHSD17B10MAPK1CYP1A2 | |
| SCHEMBL8914340 | 0.81 | CYP3A4 (0.47) | ALDH1A1KDM4EHSD17B10HPGDCASP1 | |
| SCHEMBL8915067 | 0.80 | MMP2 (0.56) | SLC1A3SLC1A2SLC1A1MMP12MMP2 | |
| SCHEMBL8912385 | 0.76 | KDM4E (0.48) | ALDH1A1KDM4EHSD17B10HPGDCASP1 | |
| SCHEMBL8912748 | 0.76 | MMP2 (0.63) | SLC1A3SLC1A2SLC1A1MMP12MMP2 | |
| SCHEMBL8914327 | 0.75 | CYP3A4 (0.48) | ALDH1A1KDM4EHSD17B10NPSR1MAPK1 | |
| SCHEMBL8914173 | 0.72 | MAPK1 (0.53) | ALDH1A1KDM4EHSD17B10CASP1CASP7 | |
| SCHEMBL8912770 | 0.72 | ROCK2 (0.53) | ALDH1A1KDM4EHSD17B10MAPK1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5663174-A | ANTIINFLAMMATORY AGENTS, INHIBITOR OF KINASES, ANTIARTHRITIC AGENTS | PHARNO-WEDROPHARM GMBH (DE) | 1997-09-02 | — | — | US | disclosed |
| EP-0602028-B1 | AROMATIC SULFONAMIDE DERIVATIVES, THEIR USE AS ENZYME INHIBITORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | PHARNO WEDROPHARM GMBH (DE) | 1996-01-17 | — | — | EP | disclosed |