Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 3/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.36 |
| ▸ | C5AR1 | P21730 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CKS1B | P61024 | 1/20 | 0.33 |
| ▸ | SKP1 | P63208 | 1/20 | 0.33 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL31615021 | 1.00 | MTOR (0.40) | MTORPARP1TNKS2PARP2C5AR1 | |
| SCHEMBL31016562 | 0.82 | C5AR1 (0.39) | MTORPARP1TNKS2PARP2C5AR1 | |
| SCHEMBL20042662 | 0.82 | C5AR1 (0.39) | MTORPARP1TNKS2PARP2C5AR1 | |
| SCHEMBL20042672 | 0.82 | MTOR (0.49) | MTORPARP1TNKS2PARP2C5AR1 | |
| SCHEMBL31614769 | 0.82 | MTOR (0.49) | MTORPARP1TNKS2PARP2C5AR1 | |
| SCHEMBL31016608 | 0.80 | PARP1 (0.37) | MTORPARP1TNKS2PARP2C5AR1 | |
| SCHEMBL20042678 | 0.78 | DDB1 (0.39) | MTORPARP1TNKS2PARP2C5AR1 | |
| SCHEMBL29329889 | 0.77 | PARP1 (0.44) | MTORPARP1TNKS2PARP2ESR2 | |
| SCHEMBL1262659 | 0.76 | PARP1 (0.43) | MTORPARP1TNKS2PARP2ESR2 | |
| SCHEMBL22503993 | 0.75 | DDB1 (0.51) | ESR2DDB1CRBNNR1H2MAPT |
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-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |