Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | CASP7 | P55210 | 2/20 | 0.46 |
| ▸ | HBB | P68871 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23953164 | 0.93 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL18727213 | 0.88 | PLAU (0.41) | ALDH1A1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL25973229 | 0.86 | EGFR (0.47) | ALDH1A1CYP3A4HSD17B10CASP1HIF1A | |
| SCHEMBL19751543 | 0.80 | ALDH1A1 (0.56) | ALDH1A1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL8156941 | 0.78 | EGFR (0.48) | ALDH1A1CYP3A4HSD17B10CASP1HIF1A | |
| SCHEMBL202182 | 0.78 | ALDH1A1 (0.72) | ALDH1A1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL29468144 | 0.78 | ALDH1A1 (0.72) | ALDH1A1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL12854930 | 0.76 | MEN1 (0.67) | ALDH1A1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL8295486 | 0.76 | CYP2A6 (0.64) | ALDH1A1HSD17B10TDP1KDM4EMEN1 | |
| SCHEMBL3412594 | 0.75 | ALDH1A1 (0.78) | ALDH1A1CYP3A4HSD17B10CASP1CASP7 |
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-118235084-A | Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element | 日产化学株式会社 | 2024-06-21 | — | — | CN | disclosed |