Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22757304 | 0.81 | ALDH1A1 (0.32) | ALDH1A1TP53TSHR | |
| SCHEMBL17614060 | 0.76 | ALDH1A1 (0.43) | ALDH1A1TP53TSHR | |
| SCHEMBL18864374 | 0.75 | — | — | |
| SCHEMBL22130751 | 0.75 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL22310784 | 0.75 | — | — | |
| SCHEMBL19980838 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TP53TSHR | |
| SCHEMBL19750086 | 0.74 | — | — | |
| SCHEMBL20218184 | 0.74 | — | — | |
| SCHEMBL22305306 | 0.74 | — | — | |
| SCHEMBL10259739 | 0.72 | ALDH1A1 (0.35) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20210139693-A1 | RESIN COMPOSITION, HYDROGEN GAS BARRIER MATERIAL, CURED PRODUCT, COMPOSITE MATERIAL, AND STRUCTURE | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2021-05-13 | — | — | US | disclosed |
| US-20190225794-A1 | GAS BARRIER MATERIAL, RESIN COMPOSITION, GAS BARRIER MEMBER, CURED PRODUCT, AND COMPOSITE MATERIAL | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2019-07-25 | — | — | US | disclosed |