Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 4/20 | 0.71 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.71 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | QDPR | P09417 | 2/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | DRD1 | P21728 | 2/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | DRD5 | P21918 | 2/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.49 |
| ▸ | DRD3 | P35462 | 2/20 | 0.49 |
| ▸ | RECQL | P46063 | 2/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL21067341 | 0.83 | BACE1 (1.00) | BACE1NUDT1TAAR1MAPK1TSHR | |
| SCHEMBL22957519 | 0.82 | NUDT1 (0.48) | BACE1NUDT1TAAR1MAPK1TSHR | |
| SCHEMBL19212128 | 0.76 | LSS (0.55) | TAAR1TSHRQDPRDRD2CYP2D6 | |
| SCHEMBL1670905 | 0.76 | NUDT1 (0.42) | BACE1NUDT1QDPRMAPTHTR1A | |
| SCHEMBL10819369 | 0.73 | QDPR (0.56) | QDPRDRD2CYP2D6THPOHTR1A | |
| SCHEMBL10597858 | 0.73 | BACE1 (0.81) | BACE1NUDT1TAAR1MAPK1KDM4E | |
| SCHEMBL12881779 | 0.72 | NUDT1 (0.69) | BACE1NUDT1TSHRDRD2DRD1 | |
| SCHEMBL27606802 | 0.72 | NUDT1 (0.56) | BACE1NUDT1MAPK1LMNAKDM4E | |
| SCHEMBL917277 | 0.71 | NUDT1 (0.72) | BACE1NUDT1TSHRDRD2DRD1 | |
| SCHEMBL10595253 | 0.70 | NUDT1 (0.77) | BACE1NUDT1ALOX15 |
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-2011154678-A1 | COMPOUNDS | ASTRAZENECA AB (SE) | 2011-12-15 | — | — | WO | disclosed |