Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F12 | P00748 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL20179720 | 0.84 | GPR88 (0.35) | F12ALDH1A1SMN1; SMN2 | |
| SCHEMBL20179716 | 0.82 | GPR88 (0.34) | F12ALDH1A1SMN1; SMN2 | |
| SCHEMBL20179645 | 0.73 | GPR88 (0.41) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL20179717 | 0.68 | TSHR (0.40) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL20179646 | 0.60 | GAA (0.43) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL21571092 | 0.57 | F12 (0.71) | F12 | |
| SCHEMBL21579639 | 0.57 | F12 (0.65) | F12 | |
| SCHEMBL21571084 | 0.57 | F12 (0.71) | F12 | |
| SCHEMBL6076695 | 0.55 | KMT2A (0.66) | ALDH1A1 | |
| SCHEMBL28195196 | 0.54 | HSD11B1 (0.54) | ALDH1A1 |
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-2018093695-A1 | FACTOR XIIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-05-24 | — | — | WO | disclosed |