Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.75 |
| ▸ | PRKACA | P17612 | 2/20 | 0.70 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.70 |
| ▸ | GSK3B | P49841 | 2/20 | 0.70 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.70 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.70 |
| ▸ | TSHR | P16473 | 3/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.68 |
| ▸ | USP2 | O75604 | 1/20 | 0.68 |
| ▸ | MAPT | P10636 | 1/20 | 0.68 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.68 |
| ▸ | HTT | P42858 | 2/20 | 0.67 |
| ▸ | BCHE | P06276 | 2/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.63 |
| ▸ | NPY1R | P25929 | 1/20 | 0.63 |
| ▸ | NPY2R | P49146 | 1/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL1899657 | 0.91 | KDM4E (0.75) | KDM4EPRKACARPS6KB1GSK3BROCK1 | |
| SCHEMBL14364650 | 0.87 | KDM4E (0.77) | KDM4EPRKACARPS6KB1GSK3BROCK1 | |
| SCHEMBL12676576 | 0.87 | KDM4E (0.80) | KDM4EPRKACARPS6KB1GSK3BROCK1 | |
| SCHEMBL1899190 | 0.86 | KDM4E (0.82) | KDM4EPRKACARPS6KB1GSK3BROCK1 | |
| SCHEMBL1900960 | 0.86 | KDM4E (1.00) | KDM4EPRKACARPS6KB1GSK3BROCK1 | |
| SCHEMBL14364657 | 0.85 | KDM4E (0.77) | KDM4EPRKACARPS6KB1GSK3BROCK1 | |
| SCHEMBL5521696 | 0.84 | KDM4E (0.75) | KDM4ETSHRMAPTBCHESMN1; SMN2 | |
| Gw549034X SCHEMBL1900661 | 0.83 | RPS6KA5 (1.00) | KDM4EPRKACARPS6KB1GSK3BROCK1 | |
| SCHEMBL1387066 | 0.83 | KDM4E (0.80) | KDM4EPRKACARPS6KB1GSK3BROCK1 | |
| SCHEMBL2578775 | 0.81 | KDM4E (0.74) | KDM4EPRKACARPS6KB1GSK3BROCK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112920178-A | Compound with benzimidazole structure and preparation method and application thereof | 中国药科大学 | 2021-06-08 | — | — | CN | claimed |
| EP-2322521-B1 | Heteroaryl compounds useful as inhibitors of GSK-3 | VERTEX PHARMA (US) | 2013-09-04 | — | — | EP | claimed |
| CN-112920178-A | Compound with benzimidazole structure and preparation method and application thereof | 中国药科大学 | 2021-06-08 | — | — | CN | disclosed |
| EP-2322521-B1 | Heteroaryl compounds useful as inhibitors of GSK-3 | VERTEX PHARMA (US) | 2013-09-04 | — | — | EP | disclosed |