Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.32 |
| ▸ | SOD1 | P00441 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL21397 | 0.80 | HSD17B10 (0.49) | HTR2AHSD17B10 | |
| SCHEMBL10916800 | 0.79 | HTR2A (0.44) | HTR2ASLC6A4KCNH2L3MBTL1NQO1 | |
| SCHEMBL12431134 | 0.77 | HSD17B10 (0.48) | HTR2AHSD17B10 | |
| SCHEMBL7083444 | 0.76 | NQO1 (0.56) | L3MBTL1NQO1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL6341676 | 0.74 | HTR2A (0.34) | HTR2ASLC6A4KCNH2L3MBTL1DHFR | |
| SCHEMBL12430145 | 0.72 | CA12 (0.49) | L3MBTL1KDM4EALDH1A1 | |
| SCHEMBL27810156 | 0.72 | ALDH1A1 (0.33) | HTR2ASLC6A4KCNH2L3MBTL1NQO1 | |
| SCHEMBL6341677 | 0.71 | ALDH1A1 (0.33) | HTR2ASLC6A4KCNH2L3MBTL1KDM4E | |
| SCHEMBL489178 | 0.70 | SMN1; SMN2 (0.44) | L3MBTL1SOD1ALDH1A1 | |
| SCHEMBL16520523 | 0.69 | TAAR1 (0.45) | L3MBTL1KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000026173-A1 | NOVEL RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE | LIGAND PHARMACEUTICALS INCORPORATED (DE) | 2000-05-11 | — | — | WO | disclosed |