Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2036323 | 0.83 | ALDH1A1 (0.50) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL14305396 | 0.82 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL10877197 | 0.80 | ALDH1A1 (0.42) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL6067613 | 0.80 | SOAT1 (0.41) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL9766511 | 0.78 | ALDH1A1 (0.41) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL6067604 | 0.77 | CYP4F2 (0.38) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL2097977 | 0.76 | CYP4F2 (0.44) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL27691346 | 0.76 | CYP4F2 (0.44) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| Hydrochloric Acid SCHEMBL5446995 | 0.75 | ALDH1A1 (0.48) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| Hydrochloric Acid SCHEMBL29726512 | 0.75 | CYP4F2 (0.52) | ALDH1A1LMNAHSD17B10PKMKDM4E |
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-2006100606-A2 | PREPARATION OF BETA-AMINO ACID PRECURSORS VIA INDIUM (III) MEDIATED MARKOVNIKOV ADDITION AND KNOEVENAGEL CONDENSATION | WARNER-LAMBERT COMPANY LLC (US) | 2006-09-28 | — | — | WO | disclosed |