Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10616023 | 1.00 | ALDH1A1 (0.35) | ALDH1A1HTTKMT2AGRM2NAAA | |
| SCHEMBL10616027 | 1.00 | ALDH1A1 (0.35) | ALDH1A1HTTKMT2AGRM2NAAA | |
| SCHEMBL10613788 | 0.99 | ALDH1A1 (0.35) | ALDH1A1HTTKMT2AGRM2NAAA | |
| SCHEMBL10613792 | 0.99 | ALDH1A1 (0.35) | ALDH1A1HTTKMT2AGRM2NAAA | |
| SCHEMBL10613783 | 0.99 | ALDH1A1 (0.35) | ALDH1A1HTTKMT2AGRM2NAAA | |
| SCHEMBL10613963 | 0.96 | ALDH1A1 (0.36) | ALDH1A1HTTKMT2ANAAACYP2C9 | |
| SCHEMBL10613958 | 0.96 | ALDH1A1 (0.36) | ALDH1A1HTTKMT2ANAAACYP2C9 | |
| SCHEMBL10613954 | 0.96 | ALDH1A1 (0.36) | ALDH1A1HTTKMT2ANAAACYP2C9 | |
| SCHEMBL10616897 | 0.94 | KMT2A (0.38) | ALDH1A1HTTKMT2ACYP2C9SERPINE1 | |
| SCHEMBL10616901 | 0.94 | KMT2A (0.38) | ALDH1A1HTTKMT2ACYP2C9SERPINE1 |
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-4784471-A | LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-11-15 | — | — | US | disclosed |