Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28235050 | 1.00 | ALDH1A1 (0.40) | ALDH1A1THRBBLMPMP22NPSR1 | |
| SCHEMBL9078915 | 1.00 | — | — | |
| SCHEMBL2206 | 0.94 | — | — | |
| SCHEMBL8054304 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL6541913 | 0.89 | — | — | |
| Water SCHEMBL5438890 | 0.89 | — | — | |
| SCHEMBL8525707 | 0.89 | — | — | |
| SCHEMBL30146908 | 0.89 | — | — | |
| SCHEMBL202872 | 0.84 | ALDH1A1 (0.38) | ALDH1A1THRBBLMPMP22NPSR1 | |
| SCHEMBL22028071 | 0.84 | ALDH1A1 (0.38) | ALDH1A1THRBBLMPMP22NPSR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57008247-A | — | — | None | — | — | JP | disclosed |
| CN-107815117-B | Deoxime type room temperature curing silicone rubber without butanone oxime generation and preparation method thereof | 浙江衢州硅宝化工有限公司 | 2021-01-05 | — | — | CN | disclosed |
| JP-S578247-A | ROOM TEMPERATURE CURABLE POLYORGANOSILOXANE COMPOSITION | TOSHIBA SILICONE CO LTD | 1982-01-16 | — | — | JP | disclosed |