Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.37 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.36 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | NQO1 | P15559 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4861556 | 0.88 | ALDH1A1 (0.42) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL29634612 | 0.88 | ALDH1A1 (0.42) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL30960875 | 0.86 | HPRT1 (0.52) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| Fluoride SCHEMBL27490468 | 0.86 | ALDH1A1 (0.41) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL28700593 | 0.86 | ALDH1A1 (0.41) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL7611626 | 0.86 | HPRT1 (0.52) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL27810887 | 0.85 | ALDH1A1 (0.40) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| Lithium Ion SCHEMBL31683852 | 0.83 | ALDH1A1 (0.41) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL19259375 | 0.82 | CYP1A2 (0.41) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| Hydrogen Sulfide SCHEMBL17372873 | 0.81 | CYP1A2 (0.40) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 |
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-105051620-A | Security element having volume hologram and printed feature | BAYER MATERIALSCIENCE AG | 2015-11-11 | — | — | CN | disclosed |