Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MGLL | Q99685 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3057905 | 0.82 | MGLL (0.44) | HSD17B10ALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL225978 | 0.82 | MGLL (0.53) | ALDH1A1CYP3A4MGLLKMT2AMAPT | |
| SCHEMBL29953220 | 0.82 | MGLL (0.53) | ALDH1A1CYP3A4MGLLKMT2AMAPT | |
| SCHEMBL3059085 | 0.82 | MGLL (0.46) | MGLLMAPTCA12CA1CA2 | |
| SCHEMBL3053613 | 0.81 | MGLL (0.45) | MGLLMAPTCA12CA1CA2 | |
| SCHEMBL6605446 | 0.78 | MGLL (0.49) | ALDH1A1MGLLKMT2ACA2POLB | |
| SCHEMBL29958250 | 0.78 | MGLL (0.49) | ALDH1A1MGLLKMT2ACA2POLB | |
| SCHEMBL13885724 | 0.77 | ALDH1A1 (0.51) | HSD17B10ALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL3049639 | 0.76 | MGLL (0.38) | HSD17B10ALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL5534564 | 0.76 | ALDH1A1 (0.50) | HSD17B10ALDH1A1TP53CYP3A4TSHR |
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-20180127652-A1 | LIQUID CRYSTAL COMPOUND HAVING BENZOTHIOPHENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2018-05-10 | — | — | US | disclosed |