Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 1/20 | 0.51 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 5/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | CA5A | P35218 | 4/20 | 0.46 |
| ▸ | CA7 | P43166 | 4/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9271675 | 0.84 | ALDH1A1 (0.45) | CA1CA2CA5ACA7CA5B | |
| SCHEMBL7381563 | 0.80 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2L3MBTL1MAPTMEN1 | |
| SCHEMBL28414626 | 0.77 | MEN1 (0.44) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL160854 | 0.75 | TSHR (0.62) | PSIP1CA1CA2CA5ACA7 | |
| Hydrochloric Acid SCHEMBL160776 | 0.74 | TSHR (0.61) | PSIP1CA1CA2CA5ACA7 | |
| SCHEMBL29337530 | 0.73 | LTA4H (0.57) | LTA4HMEN1POLBKMT2ATAAR1 | |
| SCHEMBL8605597 | 0.71 | CYP2C19 (0.47) | CA1CA2CA5ACA7CA5B | |
| SCHEMBL6383725 | 0.71 | TAAR1 (0.48) | CA1CA2CA5ACA7CA5B | |
| SCHEMBL27552713 | 0.70 | TAAR1 (0.46) | ALDH1A1SMN1; SMN2MAPTMEN1POLB | |
| SCHEMBL28284913 | 0.70 | PSIP1 (0.72) | PSIP1CA1CA2CA5ACA7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107074800-B | substituted bicyclic heteroaryl compounds as RXR agonists | 康内克斯生命科学私人有限公司 | 2019-11-12 | — | — | CN | disclosed |
| CN-107074800-A | Substituted bicyclic heteroaryl compounds as rxr agonists | 康内克斯生命科学私人有限公司 | 2017-08-18 | — | — | CN | disclosed |