Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4611540 | 0.61 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL14791321 | 0.54 | — | — | |
| SCHEMBL14216990 | 0.54 | RECQL (0.36) | CYP2C19 | |
| SCHEMBL27943730 | 0.53 | ALDH1A1 (0.36) | CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL13109438 | 0.53 | — | — | |
| SCHEMBL4953642 | 0.53 | — | — | |
| SCHEMBL24015447 | 0.52 | TSHR (0.47) | — | |
| SCHEMBL22785961 | 0.52 | TSHR (0.47) | — | |
| Biphenyl SCHEMBL1950563 | 0.52 | ALDH1A1 (0.50) | CYP1A2CYP2C19 | |
| SCHEMBL8039424 | 0.52 | HTT (0.40) | — |
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-4426335-A | Process for making phosphorus derivatives of aminothiomethylcarbamates | THE UPJOHN COMPANY (US) | 1984-01-17 | — | — | US | disclosed |