Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL27899134 | 0.77 | IDO1 (0.36) | IDO1CA2 | |
| SCHEMBL455346 | 0.77 | NOS3 (0.33) | IDO1CA2 | |
| SCHEMBL22729274 | 0.74 | CTSK (0.35) | IDO1CA2 | |
| SCHEMBL27966056 | 0.73 | CTNNB1 (0.30) | IDO1CA2 | |
| SCHEMBL7797745 | 0.73 | ALDH1A1 (0.38) | IDO1 | |
| SCHEMBL11405121 | 0.73 | RAB9A (0.31) | IDO1CA2 | |
| SCHEMBL8177689 | 0.71 | SLC6A2 (0.33) | — | |
| SCHEMBL11067597 | 0.71 | HSD11B1 (0.35) | — | |
| SCHEMBL15988597 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL4440358 | 0.70 | MEN1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5280027-A | Quinazoline containing compound | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-01-18 | — | — | US | disclosed |