Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9744986 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TSHRCASP1TRPA1MAPT | |
| SCHEMBL6657047 | 0.83 | TSHR (0.40) | ALDH1A1TSHRCASP1LMNAHSD17B10 | |
| SCHEMBL3896773 | 0.82 | ALDH1A1 (0.48) | ALDH1A1TSHRCASP1TRPA1MAPT | |
| SCHEMBL6658726 | 0.80 | TSHR (0.50) | ALDH1A1TSHRNPSR1CYP2D6CYP2C19 | |
| SCHEMBL9462351 | 0.80 | CASP1 (0.47) | ALDH1A1TSHRCASP1TRPA1MAPT | |
| SCHEMBL2799606 | 0.80 | CASP1 (0.47) | ALDH1A1TSHRCASP1TRPA1MAPT | |
| SCHEMBL14934932 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRCASP1TRPA1MAPT | |
| SCHEMBL9746312 | 0.79 | ALDH1A1 (0.42) | ALDH1A1TSHRCASP1TRPA1MAPT | |
| SCHEMBL18130150 | 0.78 | ALDH1A1 (0.45) | ALDH1A1TSHRCASP1MAPTNPSR1 | |
| SCHEMBL6658380 | 0.78 | CASP1 (0.46) | ALDH1A1TSHRCASP1TRPA1MAPT |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1370170-A | DNA methyltransferase inhibitors | PENN STATE RES FOUND (US) | 2002-09-18 | — | — | CN | claimed |
| CN-102307912-B | Particles for electrophoretic displays | MERCK PATENT GMBH | 2015-05-27 | — | — | CN | disclosed |
| CN-102307912-A | Particles for electrophoretic displays | MERCK PATENT GMBH | 2012-01-04 | — | — | CN | disclosed |
| EP-1123915-B1 | Process for producing alpha, beta-unsaturated carboxylic acid esters and catalyst for use in such process | NIPPON CATALYTIC CHEM IND (JP) | 2004-07-28 | — | — | EP | disclosed |
| US-6541656-B2 | Reacting an alpha, beta unsaturated carboxylic acid ester with a heterocyclic oxygen nitrogen, or sulfur compound | NIPPON SHOKUBAI COMPANY, LTD. (JP) | 2003-04-01 | — | — | US | disclosed |
| US-20010034300-A1 | Reacting an alpha, beta unsaturated carboxylic acid ester with a heterocyclic oxygen nitrogen, or sulfur compound | NIPPON SHOKUBAI COMPANY LTD. (JP) | 2001-10-25 | — | — | US | disclosed |
| EP-1123915-A1 | Process for producing alpha, beta-unsaturated carboxylic acid esters and catalyst for use in such process | Nippon Shokubai Co., Ltd. (JP) | 2001-08-16 | — | — | EP | disclosed |