Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.32 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.32 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL21684896 | 0.80 | CYP2C19 (0.38) | CYP4F2CYP4A11YTHDC1CYP2C19 | |
| SCHEMBL21684445 | 0.80 | CYP1A2 (0.39) | YTHDC1CYP2C19 | |
| SCHEMBL21685316 | 0.78 | MAP4K1 (0.38) | YTHDC1CYP2C19 | |
| SCHEMBL21684411 | 0.75 | MAP4K1 (0.45) | CYP2C19 | |
| SCHEMBL21685518 | 0.75 | CYP2C19 (0.34) | CYP2C19 | |
| SCHEMBL21685512 | 0.75 | PDE8B (0.33) | — | |
| SCHEMBL21684878 | 0.75 | NPC1 (0.41) | YTHDC1CYP2C19 | |
| SCHEMBL21685694 | 0.75 | DAPK1 (0.44) | CYP2C19 | |
| SCHEMBL23453236 | 0.69 | S1PR1 (0.33) | — | |
| SCHEMBL21684890 | 0.65 | MAP4K1 (0.38) | CYP2C19 |
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-2020033784-A1 | TRANSGLUTAMINASE 2 (TG2) INHIBITORS | SITARI PHARMA, INC. (US) | 2020-02-13 | — | — | WO | disclosed |