Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 6/20 | 0.35 |
| ▸ | JAK3 | P52333 | 3/20 | 0.35 |
| ▸ | IDH1 | O75874 | 2/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 6/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | CFD | P00746 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 2/20 | 0.33 |
| ▸ | NTRK3 | Q16288 | 2/20 | 0.33 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.33 |
| ▸ | LCK | P06239 | 2/20 | 0.33 |
| ▸ | CDK7 | P50613 | 2/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | LTK | P29376 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4162304 | 0.87 | IDH1 (0.33) | JAK2JAK3IDH1NTRK1HTR7 | |
| SCHEMBL4162734 | 0.82 | HTR7 (0.41) | JAK2JAK3IDH1NTRK1HTR7 | |
| SCHEMBL4169882 | 0.78 | HTR7 (0.39) | IDH1NTRK1HTR7IGF1RFGFR1 | |
| SCHEMBL4159933 | 0.77 | IGF1R (0.39) | IDH1NTRK1HTR7IGF1RFGFR1 | |
| SCHEMBL4159418 | 0.76 | IGF1R (0.37) | JAK2JAK3IDH1NTRK1IGF1R | |
| SCHEMBL5103677 | 0.75 | IGF1R (0.56) | IGF1RFGFR1KDR | |
| Hydrochloric Acid SCHEMBL4173570 | 0.75 | MAPK14 (0.36) | NTRK1MAPK14AURKAIGF1RFGFR1 | |
| SCHEMBL4158014 | 0.75 | IGF1R (0.39) | IDH1NTRK1HTR7IGF1RFGFR1 | |
| SCHEMBL4167900 | 0.74 | IGF1R (0.46) | JAK2JAK3IDH1NTRK1IGF1R | |
| SCHEMBL4161747 | 0.72 | NTRK1 (0.35) | IDH1NTRK1HTR7IGF1RFGFR1 |
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-2044063-A1 | PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER | Astra Zeneca AB (SE) | 2009-04-08 | — | — | EP | disclosed |
| WO-2008001070-A1 | PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER | ASTRAZENECA AB (SE) | 2008-01-03 | — | — | WO | disclosed |