Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1403825 | 0.78 | POLB (0.36) | POLBHCAR2PTK2CYP2A6HTT | |
| SCHEMBL19674652 | 0.73 | POLB (0.33) | POLBHCAR2PTK2CYP2A6HTT | |
| SCHEMBL30639795 | 0.73 | POLB (0.37) | POLBHCAR2PTK2HTTRAB9A | |
| SCHEMBL23943395 | 0.72 | ALDH1A1 (0.41) | RAB9AALDH1A1MAPTMAPK1 | |
| SCHEMBL19674732 | 0.69 | KDM4E (0.38) | POLBHCAR2HTTRAB9AKDM4E | |
| SCHEMBL16099522 | 0.69 | CYP2A6 (0.38) | CYP2A6ALDH1A1MAPK1 | |
| SCHEMBL19674604 | 0.68 | POLB (0.30) | POLBHCAR2 | |
| SCHEMBL23087851 | 0.68 | HTT (0.42) | POLBHCAR2PTK2CYP2A6HTT | |
| SCHEMBL14516919 | 0.67 | — | — | |
| SCHEMBL19082518 | 0.67 | ALDH1A1 (0.38) | CYP2A6HTTKDM4ELMNAHPGD |
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-3371170-B1 | INDOLIN-2-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISEASES | HOFFMANN LA ROCHE (CH) | 2019-07-31 | — | — | EP | disclosed |
| WO-2013093849-A1 | DIHYDRO-BENZO-OXAZINE AND DIHYDRO-PYRIDO-OXAZINE DERIVATIVES | NOVARTIS AG (CH) | 2013-06-27 | — | — | WO | disclosed |