Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.80 |
| ▸ | HPGD | P15428 | 1/20 | 0.80 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.80 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.80 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MGAM | O43451 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL354679 | 0.89 | ALDH1A1 (1.00) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL29623278 | 0.89 | ALDH1A1 (1.00) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7808078 | 0.88 | ALDH1A1 (0.96) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| Water SCHEMBL29724498 | 0.88 | ALDH1A1 (0.96) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL28888127 | 0.88 | ALDH1A1 (0.96) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL3829125 | 0.81 | ALDH1A1 (0.83) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL27547853 | 0.80 | ALDH1A1 (0.80) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| Quinaldic Acid SCHEMBL8695845 | 0.78 | MGAM (0.79) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL1756873 | 0.77 | ALDH1A1 (0.69) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL27347353 | 0.76 | ALDH1A1 (0.74) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5843967-A | 6-membered nitrogen-containing heteroaryl-oxazolidinones | BAYER AKTIENGESELLSCHAFT (DE) | 1998-12-01 | — | — | US | disclosed |
| US-5627181-A | BACTERICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-05-06 | — | — | US | disclosed |