Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.77 |
| ▸ | LTA4H | P09960 | 3/20 | 0.72 |
| ▸ | ESR1 | P03372 | 2/20 | 0.70 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.70 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.70 |
| ▸ | TACR2 | P21452 | 2/20 | 0.70 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.70 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.70 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.70 |
| ▸ | LMNA | P02545 | 2/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.70 |
| ▸ | SHBG | P04278 | 1/20 | 0.70 |
| ▸ | TP53 | P04637 | 1/20 | 0.70 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.70 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.70 |
| ▸ | HTR2C | P28335 | 1/20 | 0.70 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.70 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL5690043 | 0.98 | NR5A1 (0.80) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL27447908 | 0.91 | ALDH1A1 (0.68) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL29084660 | 0.89 | ALDH1A1 (0.71) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL10569132 | 0.89 | ALDH1A1 (0.71) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL27293259 | 0.89 | ALDH1A1 (0.71) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL13763215 | 0.89 | ALDH1A1 (0.71) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL10945879 | 0.89 | ALDH1A1 (0.71) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL9357898 | 0.89 | ALDH1A1 (0.71) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL9778996 | 0.89 | ALDH1A1 (0.71) | NR5A1LTA4HESR1ADRA2AADORA3 | |
| SCHEMBL56529 | 0.89 | NR5A1 (0.96) | NR5A1LTA4HESR1LMNATP53 |
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-113164941-B | Catalyst system comprising a metathesis catalyst and at least one phenolic compound and method for metathesis of nitrile rubber (NBR) using the catalyst system | 阿朗新科德国有限责任公司 | 2023-12-12 | — | — | CN | disclosed |