Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8654680 | 0.85 | ALDH1A1 (0.44) | ALDH1A1TSHRSOAT1RECQLLMNA | |
| SCHEMBL8308690 | 0.80 | ALDH1A1 (0.48) | ALDH1A1SOAT1LMNANPSR1MAPT | |
| SCHEMBL8311343 | 0.77 | ALDH1A1 (0.44) | ALDH1A1SOAT1LMNAMAPTPOLB | |
| SCHEMBL3746243 | 0.76 | ALDH1A1 (0.36) | ALDH1A1TSHRSOAT1LMNAHSD17B10 | |
| SCHEMBL5586069 | 0.75 | SMN1; SMN2 (0.32) | ALOX15 | |
| SCHEMBL8198244 | 0.74 | TSHR (0.44) | ALDH1A1TSHRRECQLLMNARAB9A | |
| Oxirane SCHEMBL29281352 | 0.74 | ALDH1A1 (0.72) | ALDH1A1TSHRSOAT1RECQLLMNA | |
| SCHEMBL5754584 | 0.73 | ALDH1A1 (0.40) | ALDH1A1SOAT1LMNAGAAHSD17B10 | |
| SCHEMBL7932550 | 0.73 | ALDH1A1 (0.55) | ALDH1A1TSHRSOAT1LMNAMAPT | |
| SCHEMBL8864065 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0799228-B1 | 3-ARYL-TETRONIC ACID DERIVATIVES, THE PRODUCTION THEREOF AND THE USE THEREOF AS ANTI-PARASITIC AGENTS | BAYER CROPSCIENCE AG (DE) | 2003-03-19 | — | — | EP | disclosed |