Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.47 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CFTR | P13569 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5999914 | 0.88 | KMT2A (0.54) | KMT2AMEN1PARP1TNKS2PARP2 | |
| SCHEMBL4147065 | 0.86 | C5AR1 (0.57) | KMT2AMEN1PARP1TNKS2PARP2 | |
| SCHEMBL183618 | 0.85 | P2RX7 (0.53) | KMT2AMEN1PARP1TNKS2PARP2 | |
| SCHEMBL16034465 | 0.85 | KMT2A (0.53) | KMT2AMEN1PARP1TNKS2PARP2 | |
| SCHEMBL183455 | 0.84 | HTR2A (0.51) | KMT2AMEN1PARP1TNKS2PARP2 | |
| Hydrochloric Acid SCHEMBL6298078 | 0.84 | P2RX7 (0.52) | KMT2AMEN1PARP1TNKS2PARP2 | |
| SCHEMBL183374 | 0.82 | PARP1 (0.46) | KMT2AMEN1PARP1TNKS2PARP2 | |
| SCHEMBL12386805 | 0.81 | P2RX7 (0.50) | KMT2AMEN1PARP1TNKS2PARP2 | |
| SCHEMBL22720440 | 0.80 | KMT2A (0.49) | KMT2AMEN1PARP1TNKS2PARP2 | |
| SCHEMBL183675 | 0.77 | HTR2A (0.64) | KMT2AMEN1PARP1TNKS2PARP2 |
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-2020239077-A1 | NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 上海翰森生物医药科技有限公司 | 2020-12-03 | — | — | WO | disclosed |