Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 5/20 | 0.65 |
| ▸ | ACHE | P22303 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.64 |
| ▸ | ALDH3A1 | P30838 | 7/20 | 0.64 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.64 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.64 |
| ▸ | BCHE | P06276 | 3/20 | 0.63 |
| ▸ | CES2 | O00748 | 1/20 | 0.63 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.62 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.62 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | APAF1 | O14727 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL18288159 | 0.84 | CES1 (0.90) | CES1ACHEALDH1A1ALDH3A1CHRM1 | |
| SCHEMBL8222390 | 0.83 | ADRA1D (0.64) | ALDH1A1CA1CA2MAPT | |
| SCHEMBL2087729 | 0.79 | ALDH1A1 (1.00) | CES1ACHEALDH1A1ALDH3A1CHRM1 | |
| SCHEMBL29506660 | 0.79 | ALDH1A1 (1.00) | CES1ACHEALDH1A1ALDH3A1CHRM1 | |
| SCHEMBL5423014 | 0.79 | CES1 (0.70) | CES1ACHEALDH1A1ALDH3A1CHRM1 | |
| SCHEMBL3027106 | 0.78 | CES1 (1.00) | CES1ACHEALDH1A1ALDH3A1CHRM1 | |
| Ammonia Solution, Strong SCHEMBL27858936 | 0.78 | ALDH1A1 (0.96) | CES1ACHEALDH1A1ALDH3A1CHRM1 | |
| SCHEMBL10960133 | 0.77 | CES1 (0.77) | CES1ACHEALDH1A1ALDH3A1CHRM1 | |
| SCHEMBL4786496 | 0.77 | CES1 (0.77) | CES1ACHEALDH1A1ALDH3A1CHRM1 | |
| SCHEMBL4597810 | 0.77 | CES1 (0.77) | CES1ACHEALDH1A1ALDH3A1CHRM1 |
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-4630401-A2 | CARBONIC ANHYDRASE ENZYME INHIBITORS AND METHODS OF USE THEREOF | Rutgers, the State University of New Jersey (US) | 2025-10-15 | — | — | EP | disclosed |
| WO-2024124023-A2 | CARBONIC ANHYDRASE ENZYME INHIBITORS AND METHODS OF USE THEREOF | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2024-06-13 | — | — | WO | disclosed |