Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24659645 | 0.81 | CYP3A4 (0.37) | CA1CA2CA9HDAC1ALDH1A1 | |
| SCHEMBL21594550 | 0.80 | PTK2 (0.38) | GAA | |
| SCHEMBL15076589 | 0.78 | CA1 (0.43) | CA1CA2CA9ALDH1A1 | |
| SCHEMBL14217945 | 0.77 | PIM1 (0.37) | PIM1HDAC1ALDH1A1KDM4EMEN1 | |
| SCHEMBL20338193 | 0.77 | PIM1 (0.40) | PIM1HDAC1ALDH1A1KDM4EMEN1 | |
| SCHEMBL30657519 | 0.77 | PIM1 (0.40) | PIM1HDAC1ALDH1A1KDM4EMEN1 | |
| SCHEMBL27955070 | 0.77 | PIM1 (0.40) | PIM1HDAC1ALDH1A1KDM4EMEN1 | |
| Bromide SCHEMBL20985008 | 0.76 | CA1 (0.42) | CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL3844562 | 0.76 | CA1 (0.42) | CA1CA2CA9ALDH1A1 | |
| SCHEMBL23020994 | 0.74 | ALDH1A1 (0.37) | CA1CA2CA9HDAC1ALDH1A1 |
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-2021026375-A1 | FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF PAIN | ALKERMES, INC. (US) | 2021-02-11 | — | — | WO | disclosed |