Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Diethyl Maleate SCHEMBL7903198 | 0.90 | HCAR2 (0.65) | HCAR2ALDH1A1MAPTCA12CA1 | |
| SCHEMBL275412 | 0.85 | — | — | |
| SCHEMBL3507591 | 0.85 | — | — | |
| SCHEMBL275413 | 0.85 | — | — | |
| Ethyl Fumarate SCHEMBL10493518 | 0.85 | HCAR2 (0.77) | HCAR2ALDH1A1MAPTCA12CA1 | |
| Ethyl Fumarate SCHEMBL27770914 | 0.85 | HCAR2 (0.77) | HCAR2ALDH1A1MAPTCA12CA1 | |
| Ethyl Fumarate SCHEMBL1720179 | 0.85 | HCAR2 (0.77) | HCAR2ALDH1A1MAPTCA12CA1 | |
| Benzene SCHEMBL29230011 | 0.84 | HCAR2 (0.61) | HCAR2ALDH1A1MAPTCA12CA1 | |
| SCHEMBL6293422 | 0.83 | — | — | |
| SCHEMBL31558519 | 0.83 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101667006-B | Novel optical holographic recording material and preparation method | UNIV WUHAN SCIENCE & ENG | 2011-05-25 | — | — | CN | disclosed |
| CN-101667006-A | Novel optical holographic recording material and preparation method | UNIV WUHAN SCIENCE & ENG | 2010-03-10 | — | — | CN | disclosed |