Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | RXRA | P19793 | 7/20 | 0.46 |
| ▸ | RXRB | P28702 | 6/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
| ▸ | RXRG | P48443 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9824854 | 0.79 | TSHR (0.54) | ALDH1A1TSHRPOLB | |
| SCHEMBL9439348 | 0.78 | ALDH1A1 (0.69) | ALDH1A1RXRARXRBSMN1; SMN2TSHR | |
| SCHEMBL1750698 | 0.78 | ALDH1A1 (0.56) | ALDH1A1RXRARXRBSMN1; SMN2NPC1 | |
| SCHEMBL9706731 | 0.78 | IDO1 (0.45) | ALDH1A1RXRARXRB | |
| SCHEMBL28004772 | 0.77 | MAPT (0.57) | ALDH1A1TSHRNPC1RAB9AHPGD | |
| SCHEMBL21533380 | 0.75 | ALDH1A1 (0.61) | ALDH1A1RXRARXRBSMN1; SMN2TSHR | |
| SCHEMBL25698415 | 0.75 | ALDH1A1 (0.53) | ALDH1A1RXRARXRBSMN1; SMN2NPC1 | |
| SCHEMBL9256064 | 0.74 | MAPT (0.62) | ALDH1A1RXRARXRBSMN1; SMN2NPC1 | |
| SCHEMBL9256061 | 0.74 | MAPT (0.62) | ALDH1A1RXRARXRBSMN1; SMN2NPC1 | |
| SCHEMBL27719363 | 0.73 | ALDH1A1 (0.54) | ALDH1A1RXRARXRBSMN1; SMN2NPC1 |
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-1992016520-A1 | MACROCYCLIC THIOETHER LIGANDS AND THEIR USE AS INTERMEDIATES FOR BINDING IONS TO SUBSTRATES | BRITISH TECHNOLOGY GROUP LTD (GB) | 1992-10-01 | — | — | WO | disclosed |