Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 8/20 | 0.46 |
| ▸ | CTSS | P25774 | 7/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 2/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | REN | P00797 | 1/20 | 0.40 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21724627 | 1.00 | CTSK (0.46) | CTSKCTSSCTSLCTSBCA12 | |
| SCHEMBL21724498 | 1.00 | CTSK (0.46) | CTSKCTSSCTSLCTSBCA12 | |
| SCHEMBL21724289 | 0.89 | CTSK (0.47) | CTSKCTSSCTSLCTSBCA12 | |
| SCHEMBL21724288 | 0.89 | CTSK (0.47) | CTSKCTSSCTSLCTSBCA12 | |
| SCHEMBL30511412 | 0.89 | BACE1 (0.48) | CTSKCTSSCTSLCTSBCA12 | |
| SCHEMBL21737915 | 0.89 | BACE1 (0.48) | CTSKCTSSCTSLCTSBCA12 | |
| SCHEMBL30910800 | 0.89 | BACE1 (0.48) | CTSKCTSSCTSLCTSBCA12 | |
| Hydrochloric Acid SCHEMBL30511421 | 0.87 | BACE1 (0.48) | CTSKCTSSCTSLCTSBCA12 | |
| SCHEMBL3839326 | 0.85 | CTSK (0.57) | CTSKCTSSCTSLCTSBCA12 | |
| SCHEMBL3839324 | 0.85 | CTSK (0.57) | CTSKCTSSCTSLCTSBCA12 |
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-3836971-A1 | CONJUGATES AND METHODS OF USING THE SAME | Flagship Pioneering Innovations V, Inc. (US) | 2021-06-23 | — | — | EP | disclosed |
| WO-2020037009-A1 | CONJUGATES AND METHODS OF USING THE SAME | FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) | 2020-02-20 | — | — | WO | disclosed |