Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 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 | |
|---|---|---|---|---|
| SCHEMBL21154999 | 0.89 | ALDH1A1 (0.36) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL19388475 | 0.84 | PKM (0.34) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL12872126 | 0.84 | ALDH1A1 (0.38) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL12819962 | 0.84 | PKM (0.34) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL25147626 | 0.80 | ADRB2 (0.44) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL9908615 | 0.80 | ADRB2 (0.44) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL11686432 | 0.77 | ALDH1A1 (0.46) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL24974307 | 0.77 | ALDH1A1 (0.35) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL10244197 | 0.76 | USP2 (0.44) | ALDH1A1GAAUSP2PKMHPGD | |
| SCHEMBL10244133 | 0.76 | USP2 (0.44) | ALDH1A1GAAUSP2PKMHPGD |
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-20160024384-A1 | LIQUID-CRYSTAL COMPOUND, LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL DISPLAY DEVICE | DAXIN MATERIALS CORPORATION (TW) | 2016-01-28 | — | — | US | disclosed |