Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | PRKCA | P17252 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7278568 | 0.82 | CYP1A2 (0.46) | CYP1A2CA1CA9ALDH1A1POLB | |
| SCHEMBL10686823 | 0.81 | CYP1A2 (0.50) | CYP1A2CA1CA9PRKCA | |
| SCHEMBL3629961 | 0.80 | CYP1A2 (0.49) | CYP1A2CA1CA9PRKCA | |
| SCHEMBL8584608 | 0.76 | CYP1A2 (0.45) | CYP1A2CA1CA9PRKCA | |
| SCHEMBL19547206 | 0.76 | CYP1A2 (0.41) | CYP1A2CA1CA9 | |
| SCHEMBL931042 | 0.74 | — | — | |
| SCHEMBL4472560 | 0.74 | — | — | |
| SCHEMBL4490657 | 0.74 | — | — | |
| SCHEMBL167570 | 0.74 | — | — | |
| SCHEMBL4472556 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0252885-A1 | Bicyclic thiaaza compounds | CIBA-GEIGY AG (CH) | 1988-01-13 | — | — | EP | disclosed |