Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.49 |
| ▸ | CSF1R | P07333 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | LPL | P06858 | 6/20 | 0.41 |
| ▸ | LIPG | Q9Y5X9 | 6/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.37 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1805374 | 0.88 | ACHE (0.42) | KDM4EFTOCSF1RMAOAMAOB | |
| SCHEMBL5314113 | 0.78 | LPL (0.47) | CSF1RLPLLIPGCA1CA2 | |
| SCHEMBL13058010 | 0.76 | CSF1R (0.64) | KDM4ECSF1RMAOALPLLIPG | |
| SCHEMBL19831190 | 0.75 | CSF1R (0.52) | KDM4ECSF1RLPLLIPGPRMT5 | |
| SCHEMBL1530430 | 0.75 | CSF1R (0.44) | KDM4ECSF1RLPLLIPGCA1 | |
| SCHEMBL29848539 | 0.74 | LPL (0.47) | LPLLIPGCA1CA2CA9 | |
| SCHEMBL10148 | 0.74 | LPL (0.47) | LPLLIPGCA1CA2CA9 | |
| SCHEMBL22291095 | 0.74 | LPL (0.42) | CSF1RLPLLIPGCA1CA2 | |
| SCHEMBL18872544 | 0.73 | NPC1 (0.51) | KDM4ECSF1RMAOAMAOBLPL | |
| SCHEMBL734384 | 0.72 | CSF1R (0.53) | KDM4ECSF1RMAOAMAOBCA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113264920-B | CDK6 inhibitor of pyrimidine benzo six-membered ring parent nucleus and preparation method and application thereof | 中国药科大学 | 2022-09-02 | — | — | CN | disclosed |