Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KMO | O15229 | 2/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.35 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.33 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.33 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30632897 | 0.84 | NFE2L2 (0.50) | NFE2L2 | |
| SCHEMBL30632939 | 0.84 | NPC1 (0.51) | NPC1RAB9ANR4A2ALDH1A1HPGD | |
| SCHEMBL30632943 | 0.82 | NFE2L2 (0.33) | NPC1RAB9ANFE2L2ALDH1A1MAPT | |
| SCHEMBL28473621 | 0.79 | CYP1A1 (0.37) | NFE2L2CNR1KDM4E | |
| SCHEMBL30632896 | 0.79 | HTR2A (0.40) | NPC1RAB9ANFE2L2ALDH1A1HPGD | |
| SCHEMBL30624911 | 0.78 | CYP1A1 (0.55) | NPC1RAB9ANFE2L2KDM4ECYP1A2 | |
| SCHEMBL30632963 | 0.78 | NFE2L2 (0.55) | NPC1RAB9ANFE2L2KDM4EL3MBTL1 | |
| SCHEMBL30632941 | 0.76 | HTR2A (0.38) | — | |
| SCHEMBL30632906 | 0.75 | NUDT1 (0.36) | NFE2L2CYP2C19 | |
| SCHEMBL30632990 | 0.74 | KDM4E (0.47) | NPC1RAB9ANFE2L2CNR1ALDH1A1 |
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-111886234-B | Heterocyclic mitochondrial activity inhibitors and uses thereof | 蒙特利尔大学 | 2023-12-15 | — | — | CN | disclosed |