Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.71 |
| ▸ | NPC1 | O15118 | 5/20 | 0.71 |
| ▸ | TP53 | P04637 | 2/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.59 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.59 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.56 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| Ether SCHEMBL28282920 | 0.93 | NPC1 (0.62) | RAB9ANPC1TP53SMN1; SMN2POLB | |
| SCHEMBL1499642 | 0.83 | RAB9A (1.00) | RAB9ANPC1TP53SMN1; SMN2POLB | |
| SCHEMBL30758588 | 0.83 | RAB9A (1.00) | RAB9ANPC1TP53SMN1; SMN2POLB | |
| SCHEMBL25378644 | 0.82 | HTT (0.56) | RAB9ANPC1SMN1; SMN2KMT2ARXFP1 | |
| SCHEMBL4254148 | 0.78 | RAB9A (0.76) | RAB9ANPC1TP53SMN1; SMN2POLB | |
| SCHEMBL4248720 | 0.78 | RXFP1 (0.76) | RAB9ANPC1TP53SMN1; SMN2POLB | |
| SCHEMBL12468557 | 0.77 | AVPR2 (0.75) | RAB9ANPC1TP53SMN1; SMN2POLB | |
| SCHEMBL18845166 | 0.77 | KMT2A (0.82) | RAB9ANPC1TP53SMN1; SMN2POLB | |
| SCHEMBL10055020 | 0.76 | NPC1 (0.94) | RAB9ANPC1TP53SMN1; SMN2KMT2A | |
| SCHEMBL4436642 | 0.76 | KCNK3 (0.77) | RAB9ANPC1TP53SMN1; SMN2POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109369526-A | A kind of synthetic method and its antitumor application thereof of nitidine derivative | 桂林理工大学 | 2019-02-22 | — | — | CN | claimed |
| CN-109369526-A | A kind of synthetic method and its antitumor application thereof of nitidine derivative | 桂林理工大学 | 2019-02-22 | — | — | CN | disclosed |