Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL20122464 | 0.93 | — | — | |
| SCHEMBL20122427 | 0.91 | CYP1A2 (0.33) | CYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL20122425 | 0.90 | FOLH1 (0.32) | — | |
| SCHEMBL20122426 | 0.89 | — | — | |
| SCHEMBL20122415 | 0.89 | FOLH1 (0.30) | — | |
| SCHEMBL20122560 | 0.89 | CYP1A2 (0.31) | CYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL20122548 | 0.87 | — | — | |
| SCHEMBL20122542 | 0.85 | — | — | |
| SCHEMBL20122469 | 0.85 | CHRM1 (0.34) | — | |
| SCHEMBL20122467 | 0.85 | TACR1 (0.36) | CYP1A2CYP2C9CYP2C19 |
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-9963428-B1 | Bucillamine prodrugs, pharmaceutical compositions thereof, and methods of use | Nguyen, Mark Quang (US) | 2018-05-08 | — | — | US | disclosed |