Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 6/20 | 0.43 |
| ▸ | MAOA | P21397 | 5/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.41 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 3/20 | 0.39 |
| ▸ | CNR2 | P34972 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8778527 | 0.86 | AHR (0.50) | ALDH1A1AHRPLA2G2ACNR1CNR2 | |
| SCHEMBL6481956 | 0.85 | ALDH1A1 (0.52) | ALDH1A1FFAR1PPARGPPARDPPARA | |
| SCHEMBL1047361 | 0.83 | MAPT (0.51) | ALDH1A1SMN1; SMN2NPSR1MAPK1HSD17B10 | |
| SCHEMBL6748734 | 0.83 | MAPT (0.51) | ALDH1A1SMN1; SMN2NPSR1MAPK1HSD17B10 | |
| SCHEMBL8920272 | 0.81 | SMN1; SMN2 (0.44) | SMN1; SMN2MAPK1 | |
| SCHEMBL11044739 | 0.81 | TUBB1 (0.46) | — | |
| SCHEMBL1044851 | 0.81 | MAPT (0.53) | ALDH1A1KCNA3SMN1; SMN2NPSR1MAPK1 | |
| SCHEMBL7390211 | 0.81 | ALDH1A1 (0.48) | ALDH1A1FFAR1PPARGPPARDPPARA | |
| SCHEMBL28360552 | 0.81 | PLA2G2A (0.59) | ALDH1A1MAOBMAOAAHRPLA2G2A | |
| SCHEMBL7972707 | 0.79 | ALDH1A1 (0.46) | ALDH1A1FFAR1PPARGPPARDPPARA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0574355-B1 | Phosphinyloxy propanaminium inner salt derivatives | CIBA GEIGY AG (CH) | 1997-08-13 | — | — | EP | claimed |
| EP-0574355-A1 | Phosphinyloxy propanaminium inner salt derivatives | SANDOZ LTD. (CH) | 1993-12-15 | — | — | EP | claimed |