Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.38 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24815700 | 1.00 | ESR1 (0.40) | ESR1HSP90AA1HSP90AB1POLBNPC1 | |
| SCHEMBL29986504 | 0.89 | ALDH1A1 (0.44) | POLBNPC1PKMRAB9AALDH1A1 | |
| SCHEMBL24815671 | 0.89 | ALDH1A1 (0.44) | POLBNPC1PKMRAB9AALDH1A1 | |
| SCHEMBL29987274 | 0.87 | NAMPT (0.46) | NAMPT | |
| SCHEMBL24814393 | 0.87 | NAMPT (0.46) | NAMPT | |
| SCHEMBL26845914 | 0.87 | NAMPT (0.43) | POLBRAB9AALDH1A1SMN1; SMN2NAMPT | |
| SCHEMBL24815715 | 0.85 | NAMPT (0.46) | ESR1ESR2CA1CA2CA7 | |
| SCHEMBL29987244 | 0.85 | NAMPT (0.46) | ESR1ESR2CA1CA2CA7 | |
| SCHEMBL24814718 | 0.81 | AOC3 (0.49) | ABHD6ALDH1A1NAMPT | |
| SCHEMBL29986210 | 0.81 | AOC3 (0.49) | ABHD6ALDH1A1NAMPT |
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-2022251343-A2 | CDGSH IRON SULFUR DOMAIN 2 ACTIVATORS AND USE THEREOF | NATIONAL HEALTH RESEARCH INSTITUTES (TW) | 2022-12-01 | — | — | WO | disclosed |