Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 5/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | USP7 | Q93009 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | WEE1 | P30291 | 2/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28234020 | 0.82 | ALOX5 (0.54) | MIFCA12CA9ESR1ESR2 | |
| SCHEMBL30688682 | 0.81 | ESR1 (0.46) | CA12CA9ESR1ESR2MAPT | |
| SCHEMBL2477380 | 0.81 | ESR1 (0.46) | CA12CA9ESR1ESR2MAPT | |
| SCHEMBL20687373 | 0.80 | S100A4 (0.44) | MAPTHSD17B10MEN1NPC1ALDH1A1 | |
| Methane SCHEMBL28112789 | 0.80 | ALOX5 (0.52) | MIFCA12CA9ESR1ESR2 | |
| SCHEMBL30641853 | 0.77 | CA12 (0.46) | CA12CA9ESR1ESR2MAPT | |
| SCHEMBL30097499 | 0.77 | HSD11B1 (0.55) | NPC1ALDH1A1HPGDRAB9AKMT2A | |
| SCHEMBL10664062 | 0.77 | HSD11B1 (0.55) | NPC1ALDH1A1HPGDRAB9AKMT2A | |
| SCHEMBL2846646 | 0.77 | HSD11B1 (0.55) | NPC1ALDH1A1HPGDRAB9AKMT2A | |
| SCHEMBL9446142 | 0.76 | CA12 (0.49) | MIFCA12CA9ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109943349-B | Liquid-crystalline medium with homeotropic alignment | 默克专利股份有限公司 | 2024-07-05 | — | — | CN | disclosed |