Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.87 |
| ▸ | MEN1 | O00255 | 7/20 | 0.84 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.84 |
| ▸ | MAPT | P10636 | 6/20 | 0.84 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.72 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.66 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.66 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.66 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.66 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.66 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.66 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.66 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL28135254 | 0.93 | NPC1 (0.77) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL28251671 | 0.92 | NPC1 (0.74) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL2744059 | 0.92 | NPC1 (0.74) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL4901279 | 0.87 | MAPT (0.71) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL4901196 | 0.87 | MAPT (0.71) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL30450773 | 0.84 | NPC1 (0.64) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL29014966 | 0.84 | NPC1 (0.64) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL2666274 | 0.83 | CLK4 (0.63) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL16608063 | 0.83 | NPC1 (0.63) | NPC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL2743607 | 0.83 | MEN1 (0.64) | NPC1MEN1KMT2AMAPTALDH1A1 |
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-106632076-B | 4,6- diphenylpyrimidin class compound, preparation method and medical usage | 中国药科大学 | 2019-04-30 | — | — | CN | disclosed |