Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.67 |
| ▸ | NLN | Q9BYT8 | 3/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL18162790 | 0.86 | CYP3A4 (0.69) | CYP3A4SLC7A5NLN | |
| SCHEMBL13331622 | 0.86 | CYP3A4 (0.69) | CYP3A4SLC7A5NLN | |
| SCHEMBL27946609 | 0.86 | CYP3A4 (0.69) | CYP3A4SLC7A5NLN | |
| SCHEMBL6957266 | 0.86 | CYP3A4 (0.69) | CYP3A4SLC7A5NLN | |
| SCHEMBL27913326 | 0.83 | CYP3A4 (0.69) | CYP3A4SLC7A5NLN | |
| SCHEMBL19227330 | 0.82 | CYP3A4 (0.63) | CYP3A4SLC7A5NLN | |
| SCHEMBL12259752 | 0.82 | CYP3A4 (0.63) | CYP3A4SLC7A5NLN | |
| Histidine SCHEMBL26659431 | 0.81 | CYP3A4 (0.71) | CYP3A4SLC7A5 | |
| SCHEMBL18862447 | 0.81 | CYP3A4 (0.61) | CYP3A4SLC7A5NLN | |
| SCHEMBL18878637 | 0.81 | NLN (0.66) | CYP3A4SLC7A5NLN |
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 |
|---|---|---|---|---|---|---|---|
| CN-1113874-C | Benzocycloalkylazolethione derivatives | SYNTEX INC (US) | 2003-07-09 | — | — | CN | disclosed |
| CN-1151735-A | Benzocycloalkylazolethione derivatives | SYNTEX INC (US) | 1997-06-11 | — | — | CN | disclosed |