Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4298986 | 0.81 | ALDH1A1 (0.37) | ALDH1A1SLC22A6MEN1NPC1KMT2A | |
| SCHEMBL1300672 | 0.81 | ALDH1A1 (0.37) | ALDH1A1SLC22A6MEN1NPC1KMT2A | |
| SCHEMBL6668703 | 0.81 | TDP1 (0.41) | ALDH1A1SLC22A6MEN1NPC1KMT2A | |
| SCHEMBL16488722 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MEN1NPC1KMT2ALMNA | |
| SCHEMBL17040285 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MEN1NPC1KMT2ALMNA | |
| SCHEMBL10123401 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MEN1NPC1KMT2ALMNA | |
| SCHEMBL1548356 | 0.79 | MEN1 (0.36) | ALDH1A1SLC22A6MEN1NPC1KMT2A | |
| SCHEMBL6670670 | 0.79 | TDP1 (0.50) | ALDH1A1SLC22A6MEN1NPC1KMT2A | |
| Bicarbonate SCHEMBL28431654 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MEN1NPC1KMT2ALMNA | |
| Bicarbonate SCHEMBL28431656 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MEN1NPC1KMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4992544-A | Intermediates for b-lactam antibiotics and b-lactamase inhibitor | UNIVERSITY OF NOTRE DAME DU LAC (US) | 1991-02-12 | — | — | US | disclosed |