Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.38 |
| ▸ | MTOR | P42345 | 3/20 | 0.38 |
| ▸ | KDR | P35968 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8089090 | 0.95 | KDR (0.39) | PIK3CAMTORKDRMEN1KMT2A | |
| SCHEMBL8090804 | 0.87 | MTOR (0.37) | PIK3CAMTORKDRKMT2ARAB9A | |
| SCHEMBL8085149 | 0.85 | PIK3CA (0.39) | PIK3CAMTORKDRKDM4EALDH1A1 | |
| SCHEMBL8097954 | 0.83 | MAPK1 (0.33) | PIK3CAKDRCA12CA1CA2 | |
| SCHEMBL8093434 | 0.83 | PIK3CD (0.35) | PIK3CARAB9A | |
| SCHEMBL8091977 | 0.83 | PIK3CD (0.35) | PIK3CAALDH1A1RAB9AGAA | |
| SCHEMBL8097960 | 0.83 | KDM4E (0.38) | PIK3CAMTORKDRMEN1KMT2A | |
| SCHEMBL8084016 | 0.83 | CA12 (0.41) | PIK3CAMTORKDRMEN1KMT2A | |
| SCHEMBL8098772 | 0.83 | PIK3CD (0.39) | PIK3CAMTORKDRMEN1KMT2A | |
| SCHEMBL8089088 | 0.83 | PIK3CA (0.40) | PIK3CAMTORKDRKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009007748-A2 | TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | ASTRAZENECA AB (SE) | 2009-01-15 | — | — | WO | disclosed |