Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | G6PD | P11413 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 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 | |
|---|---|---|---|---|
| SCHEMBL24028061 | 1.00 | NPC1 (0.34) | NPC1RAB9AMAPTLMNAPOLB | |
| SCHEMBL24028074 | 0.88 | RPS6KA2 (0.36) | L3MBTL1MAP4K1PDE4APDE4BPDE4C | |
| SCHEMBL30213035 | 0.88 | RPS6KA2 (0.36) | L3MBTL1MAP4K1PDE4APDE4BPDE4C | |
| SCHEMBL24028393 | 0.87 | PDE4A (0.34) | MAPTL3MBTL1S1PR1PDE4APDE4B | |
| SCHEMBL30212933 | 0.79 | HSP90AA1 (0.39) | NPC1RAB9AMAPTLMNAPOLB | |
| SCHEMBL24028217 | 0.79 | HSP90AA1 (0.39) | NPC1RAB9AMAPTLMNAPOLB | |
| SCHEMBL30212881 | 0.78 | ALDH1A1 (0.39) | RAB9ALMNAPOLBALDH1A1SMN1; SMN2 | |
| SCHEMBL24028387 | 0.78 | ALDH1A1 (0.39) | RAB9ALMNAPOLBALDH1A1SMN1; SMN2 | |
| SCHEMBL24028389 | 0.76 | ALDH1A1 (0.33) | NPC1RAB9AMAPTLMNAPOLB | |
| SCHEMBL30212963 | 0.76 | ALDH1A1 (0.33) | NPC1RAB9AMAPTLMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-4149928-A1 | IMIDAZOLE 3-OXIDE DERIVATIVE BASED ACSS2 INHIBITORS AND METHODS OF USE THEREOF | Metabomed Ltd (IL) | 2023-03-22 | — | — | EP | disclosed |
| CN-115697974-A | Imidazole 3-oxide derivative based ACSS2 inhibitors and methods of use thereof | 美特波米德有限公司 | 2023-02-03 | — | — | CN | disclosed |