Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 4/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.40 |
| ▸ | MST1R | Q04912 | 1/20 | 0.40 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.40 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7974328 | 0.73 | CA1 (0.46) | CA2CA9CA12CA1ALOX5AP | |
| SCHEMBL3380244 | 0.72 | HTR6 (0.49) | CA2CA9CA12CA1ALDH1A1 | |
| SCHEMBL10864060 | 0.72 | HTR6 (0.49) | CA2CA9CA12CA1ALDH1A1 | |
| SCHEMBL28890398 | 0.71 | HTR6 (0.47) | CA2CA9CA12CA1ALDH1A1 | |
| SCHEMBL7868588 | 0.71 | CA12 (0.45) | CDK9CA2CA9CA12CA1 | |
| SCHEMBL31105626 | 0.70 | ALOX5AP (0.42) | CA2CA9CA1ALOX5APFEN1 | |
| SCHEMBL28569491 | 0.68 | CA1 (0.56) | PDGFRBCA2CA9CA12CA1 | |
| SCHEMBL529620 | 0.68 | HTR6 (0.60) | CA2CA9CA12CA1ALDH1A1 | |
| SCHEMBL29581383 | 0.68 | HTR6 (0.60) | CA2CA9CA12CA1ALDH1A1 | |
| SCHEMBL31598810 | 0.68 | PTGES2 (0.58) | CA2CA9CA12CA1ALOX5AP |
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-1137642-A1 | BIS-SULFONAMIDES | Actelion Pharmaceuticals Ltd. (CH) | 2001-10-04 | — | — | EP | disclosed |
| WO-2001017976-A1 | BIS-SULFONAMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2001-03-15 | — | — | WO | disclosed |