Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | CPB1 | P15086 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9753142 | 0.77 | HTT (0.44) | ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL23771510 | 0.75 | CACNA1B (0.40) | ALDH1A1CYP3A4 | |
| SCHEMBL9753437 | 0.73 | HTT (0.46) | ALDH1A1 | |
| SCHEMBL10007476 | 0.72 | CPB1 (0.44) | ALDH1A1NPC1RAB9ASMN1; SMN2CPB1 | |
| SCHEMBL27868267 | 0.69 | TSHR (0.43) | ALDH1A1NPC1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL9977775 | 0.69 | SMN1; SMN2 (0.42) | ALDH1A1MAPTNPSR1SMN1; SMN2 | |
| SCHEMBL9977777 | 0.69 | SMN1; SMN2 (0.42) | ALDH1A1MAPTNPSR1SMN1; SMN2 | |
| SCHEMBL9977722 | 0.69 | SMN1; SMN2 (0.42) | ALDH1A1MAPTNPSR1SMN1; SMN2 | |
| SCHEMBL29118168 | 0.69 | ALDH1A1 (0.54) | ALDH1A1HPGDMAPTNPSR1HSD17B10 | |
| Benzyl Alcohol SCHEMBL27670531 | 0.68 | ALDH1A1 (0.57) | ALDH1A1HPGDMAPTNPSR1HSD17B10 |
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-1991007378-A1 | CYCLOALKYL-SUBSTITUTED GLUTARAMIDE DIURETIC AGENTS | PFIZER LIMITED (GB) | 1991-05-30 | — | — | WO | disclosed |