Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Ethyl Bromo Acetate SCHEMBL30029347 | 0.95 | ALDH1A1 (0.45) | ALDH1A1TRPA1MEN1KMT2AMAPT | |
| SCHEMBL30028689 | 0.93 | MEN1 (0.43) | ALDH1A1MEN1KMT2AMAPTCYP3A4 | |
| Ethyl Bromo Acetate SCHEMBL30028633 | 0.88 | ALDH1A1 (0.44) | ALDH1A1TRPA1MEN1KMT2AMAPT | |
| SCHEMBL8912197 | 0.87 | KMT2A (0.45) | ALDH1A1MEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL5114769 | 0.82 | MEN1 (0.40) | ALDH1A1MEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL8912207 | 0.80 | MEN1 (0.38) | ALDH1A1MEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL5121809 | 0.79 | GSK3A (0.40) | ALDH1A1MEN1KMT2AMAPTPOLB | |
| SCHEMBL9698278 | 0.75 | ENPP2 (0.38) | ALDH1A1KMT2APOLBSMN1; SMN2KDM4E | |
| SCHEMBL14014876 | 0.75 | MEN1 (0.33) | ALDH1A1MEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL5653075 | 0.74 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2APOLBSMN1; SMN2 |
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-2022175402-A1 | QUINUCLIDINE-3-ONE DERIVATIVES | APREA THERAPEUTICS AB (SE) | 2022-08-25 | — | — | WO | disclosed |