Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TTK | P33981 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.40 |
| ▸ | TACR3 | P29371 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | F7 | P08709 | 1/20 | 0.37 |
| ▸ | F3 | P13726 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 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 | |
|---|---|---|---|---|
| SCHEMBL20217231 | 0.85 | CYP3A4 (0.43) | TAS1R3TAS1R1CYP3A4TTKAURKB | |
| SCHEMBL20217171 | 0.85 | CYP3A4 (0.43) | TAS1R3TAS1R1CYP3A4TTKAURKB | |
| SCHEMBL20217438 | 0.78 | KDM4E (0.50) | CYP3A4L3MBTL1NPC1POLBRAB9A | |
| SCHEMBL20217226 | 0.77 | CYP3A4 (0.44) | TAS1R3TAS1R1CYP3A4TTKAURKB | |
| SCHEMBL20217586 | 0.75 | TAS1R3 (0.35) | TAS1R3TAS1R1F2F10F7 | |
| SCHEMBL20217912 | 0.71 | CYP3A4 (0.43) | CYP3A4TTKAURKBINCENPS1PR2 | |
| SCHEMBL20217678 | 0.70 | ALDH1A1 (0.38) | CYP3A4TTKAURKBINCENPF2 | |
| SCHEMBL20217347 | 0.70 | ALDH1A1 (0.47) | TAS1R3TAS1R1PPARGLMNA | |
| SCHEMBL20217403 | 0.70 | TAS1R3 (0.43) | TAS1R3TAS1R1PPARGLMNA | |
| SCHEMBL20217428 | 0.69 | CYP3A4 (0.41) | CYP3A4TTKAURKBINCENPF7 |
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-2766352-B1 | INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIV HEALTH NETWORK UHN (CA) | 2018-06-06 | — | — | EP | disclosed |