Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | JAK1 | P23458 | 1/20 | 0.42 |
| ▸ | TYK2 | P29597 | 1/20 | 0.42 |
| ▸ | JAK3 | P52333 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4771971 | 0.85 | AVPR1A (0.50) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| SCHEMBL12127425 | 0.85 | KDM4E (0.49) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| SCHEMBL4882143 | 0.83 | DRD2 (0.56) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| SCHEMBL557776 | 0.80 | KDM4E (0.70) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| Hydrochloric Acid SCHEMBL1703924 | 0.79 | KDM4E (0.68) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| SCHEMBL892836 | 0.79 | OPRM1 (0.53) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| SCHEMBL30567991 | 0.79 | OPRM1 (0.53) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| SCHEMBL12127418 | 0.79 | KDM4E (0.49) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| Hydrochloric Acid SCHEMBL1703941 | 0.78 | OPRM1 (0.52) | KDM4EBRD4ALDH1A1POLBCREBBP | |
| SCHEMBL8618496 | 0.77 | CYP1A2 (0.63) | KDM4EBRD4ALDH1A1POLBCREBBP |
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-3717477-A1 | NEW HETEROCYCLIC COMPOUNDS | H. Hoffnabb-La Roche Ag (CH) | 2020-10-07 | — | — | EP | disclosed |