Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | PAK4 | O96013 | 6/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6978475 | 1.00 | MEN1 (0.40) | MEN1KMT2AROCK2PTGESBCHE | |
| SCHEMBL3148082 | 0.93 | PTGES (0.41) | MEN1KMT2AROCK2PTGESBCHE | |
| SCHEMBL3148074 | 0.93 | PTGES (0.41) | MEN1KMT2AROCK2PTGESBCHE | |
| SCHEMBL6982535 | 0.91 | ROCK2 (0.43) | ROCK2PAK4CYP3A4CYP2C9 | |
| SCHEMBL6982529 | 0.91 | ROCK2 (0.43) | ROCK2PAK4CYP3A4CYP2C9 | |
| SCHEMBL6971265 | 0.90 | JAK3 (0.41) | MEN1KMT2AROCK2PTGESBCHE | |
| SCHEMBL6971260 | 0.90 | JAK3 (0.41) | MEN1KMT2AROCK2PTGESBCHE | |
| SCHEMBL7227041 | 0.90 | KDM1A (0.39) | MEN1KMT2AROCK2BCHEKDM1A | |
| SCHEMBL7227045 | 0.90 | KDM1A (0.39) | MEN1KMT2AROCK2BCHEKDM1A | |
| SCHEMBL6986773 | 0.90 | LMNA (0.42) | ROCK2BCHEPAK4CYP3A4SMN1; SMN2 |
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-1071665-B1 | SUBSTITUTED INDOLINONES HAVING AN INHIBITING EFFECT ON KINASES AND CYCLINE/CDK COMPLEXES | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-10-01 | — | — | EP | disclosed |
| US-6169106-B1 | ANTITUMOUR AGENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-01-02 | — | — | US | disclosed |