Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.53 |
| ▸ | RAB9A | P51151 | 10/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 6/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21612951 | 0.78 | RAB9A (0.42) | NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1 | |
| SCHEMBL28633833 | 0.71 | HPGD (0.39) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL5648948 | 0.71 | SMN1; SMN2 (0.41) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL5649629 | 0.71 | ALDH1A1 (0.45) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL829826 | 0.70 | SMN1; SMN2 (1.00) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL18093695 | 0.68 | NPC1 (0.55) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL21612900 | 0.67 | RAB9A (0.39) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL25296039 | 0.65 | HDAC8 (0.47) | NPC1RAB9AMAPTATMTDP1 | |
| SCHEMBL830131 | 0.65 | SMN1; SMN2 (0.72) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL30886888 | 0.64 | HDAC8 (0.39) | NPC1RAB9ASMN1; SMN2MAPTLMNA |
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-116249554-A | Compounds and their use in the treatment of cancer | 阿斯利康(瑞典)有限公司 | 2023-06-09 | — | — | CN | disclosed |