Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Imidazole SCHEMBL17583814 | 0.83 | ALDH1A1 (0.45) | ALDH1A1FKBP5CA12CA1CA2 | |
| Imidazole SCHEMBL28210381 | 0.81 | ALDH1A1 (0.43) | ALDH1A1FKBP5CA12CA1CA2 | |
| SCHEMBL10701485 | 0.77 | CA1 (0.58) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL28349686 | 0.74 | CA1 (0.55) | ALDH1A1CA12CA1CA2CA7 | |
| Hydrochloric Acid SCHEMBL28054073 | 0.74 | CA1 (0.55) | ALDH1A1CA12CA1CA2CA7 | |
| Imidazole SCHEMBL5246988 | 0.72 | — | — | |
| Imidazole SCHEMBL11380344 | 0.70 | — | — | |
| Imidazole SCHEMBL28633592 | 0.69 | — | — | |
| Imidazole SCHEMBL3240045 | 0.69 | — | — | |
| Imidazole SCHEMBL425785 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109790383-A | Polymer composition | 日产化学株式会社 | 2019-05-21 | — | — | CN | disclosed |