Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Acrylic Acid Methyl Ester SCHEMBL4814930 | 0.81 | CA2 (0.40) | ALDH1A1CA2TMEM97SIGMAR1NPSR1 | |
| Glycidol SCHEMBL21494170 | 0.80 | ALDH1A1 (0.58) | ALDH1A1TSHR | |
| Acetic Acid SCHEMBL15955948 | 0.80 | CA2 (0.46) | ALDH1A1CA2TMEM97SIGMAR1NPSR1 | |
| SCHEMBL3683010 | 0.80 | CA2 (0.42) | ALDH1A1CA2TMEM97SIGMAR1NPSR1 | |
| SCHEMBL4965571 | 0.80 | CA2 (0.47) | ALDH1A1CA2TMEM97SIGMAR1NPSR1 | |
| SCHEMBL220145 | 0.80 | — | — | |
| SCHEMBL221388 | 0.80 | — | — | |
| SCHEMBL23556 | 0.80 | — | — | |
| SCHEMBL14470792 | 0.78 | ALDH1A1 (0.65) | ALDH1A1CA2TMEM97SIGMAR1NPSR1 | |
| SCHEMBL378537 | 0.78 | ALDH1A1 (0.65) | ALDH1A1CA2TMEM97SIGMAR1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7416867-B2 | Enzymatic production of (meth)acrylic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2008-08-26 | — | — | US | disclosed |
| US-20060141593-A1 | Enzymatic production of (meth) acrylic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2006-06-29 | — | — | US | disclosed |