Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | NPC1 | O15118 | 3/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | RORC | P51449 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | DUSP3 | P51452 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | LCK | P06239 | 1/20 | 0.49 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29947482 | 0.90 | KDM4E (0.50) | KDM4EALDH1A1NPC1HPGDMAPT | |
| SCHEMBL24729518 | 0.90 | KDM4E (0.50) | KDM4EALDH1A1NPC1HPGDMAPT | |
| SCHEMBL24729427 | 0.84 | RAB9A (0.53) | KDM4EALDH1A1NPC1HPGDMAPT | |
| SCHEMBL29947329 | 0.84 | RAB9A (0.53) | KDM4EALDH1A1NPC1HPGDMAPT | |
| SCHEMBL24729405 | 0.83 | HTT (0.54) | KDM4EALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL29947693 | 0.83 | HTT (0.54) | KDM4EALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL23657486 | 0.81 | ALDH1A1 (0.69) | KDM4EALDH1A1NPC1HPGDRORC | |
| SCHEMBL4909146 | 0.80 | NPC1 (0.65) | KDM4EALDH1A1NPC1HPGDRORC | |
| SCHEMBL24729254 | 0.80 | ALDH1A1 (0.59) | KDM4EALDH1A1NPC1HPGDRORC | |
| SCHEMBL24729368 | 0.77 | HTT (0.61) | KDM4EALDH1A1NPC1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022240213-A1 | NOVEL BENZOTHIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF FOR PREVENTION OR TREATMENT OF LIVER DISEASE | 에이치케이이노엔 주식회사 | 2022-11-17 | — | — | WO | disclosed |