Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 6/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 5/20 | 0.44 |
| ▸ | NTRK2 | Q16620 | 5/20 | 0.44 |
| ▸ | AURKA | O14965 | 4/20 | 0.44 |
| ▸ | LCK | P06239 | 4/20 | 0.44 |
| ▸ | FYN | P06241 | 4/20 | 0.44 |
| ▸ | LYN | P07948 | 4/20 | 0.44 |
| ▸ | FLT3 | P36888 | 4/20 | 0.44 |
| ▸ | MAPK9 | P45984 | 4/20 | 0.44 |
| ▸ | BLK | P51451 | 4/20 | 0.44 |
| ▸ | RPS6KA3 | P51812 | 4/20 | 0.44 |
| ▸ | STK3 | Q13188 | 4/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.44 |
| ▸ | MARK2 | Q7KZI7 | 4/20 | 0.44 |
| ▸ | PLK4 | O00444 | 3/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.44 |
| ▸ | ABL1 | P00519 | 3/20 | 0.44 |
| ▸ | CSF1R | P07333 | 3/20 | 0.44 |
| ▸ | MET | P08581 | 3/20 | 0.44 |
| ▸ | KIT | P10721 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL59021 | 0.89 | KDR (0.44) | KDRNTRK1NTRK2AURKALCK | |
| SCHEMBL58190 | 0.87 | FLT3 (0.42) | KDRNTRK1NTRK2AURKALCK | |
| SCHEMBL90885 | 0.81 | ACVRL1 (0.61) | FLT3AXLMERTKTYRO3ACVRL1 | |
| SCHEMBL60736 | 0.79 | NTRK1 (0.43) | KDRNTRK1NTRK2AURKALCK | |
| SCHEMBL57029 | 0.77 | AXL (0.41) | KDRNTRK1NTRK2AURKALCK | |
| SCHEMBL59041 | 0.76 | NTRK1 (0.49) | KDRNTRK1NTRK2AURKALCK | |
| SCHEMBL60270 | 0.75 | ACVRL1 (0.50) | AXLMERTKTYRO3ACVRL1PIK3CD | |
| SCHEMBL59784 | 0.75 | AURKB (0.40) | KDRNTRK1NTRK2AURKALCK | |
| SCHEMBL58728 | 0.75 | ACVRL1 (0.44) | KDRNTRK1NTRK2AURKALCK | |
| SCHEMBL58313 | 0.74 | KDR (0.59) | KDRNTRK1NTRK2AURKALCK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1957485-B1 | SUBSTITUTED 4-AMINO-PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS | BAYER HEALTHCARE LLC (US) | 2013-02-13 | — | — | EP | disclosed |