Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.48 |
| ▸ | RAB9A | P51151 | 9/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.44 |
| ▸ | TP53 | P04637 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | PKM | P14618 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9499089 | 0.83 | NPC1 (0.52) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL2123636 | 0.79 | NPC1 (0.48) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL346909 | 0.79 | NPC1 (0.50) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL20733702 | 0.79 | PSMB8 (0.50) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL29818654 | 0.78 | LTA4H (0.61) | NPC1RAB9AMAPTPSMB8SMN1; SMN2 | |
| SCHEMBL10668448 | 0.78 | NPC1 (0.49) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL21629495 | 0.77 | RAB9A (0.47) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL358439 | 0.76 | LTA4H (0.56) | NPC1RAB9AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL12411071 | 0.76 | MAPT (0.46) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL25460357 | 0.75 | NPC1 (0.44) | NPC1RAB9AMAPTMEN1KMT2A |
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-113648413-B | Preparation method of supermolecular photoactive metal nano antibacterial drug | 南开大学 | 2022-07-29 | — | — | CN | disclosed |