Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | MGAM | O43451 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SI | P14410 | 1/20 | 0.44 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| Ethyl Acetate SCHEMBL28211825 | 0.84 | ALDH1A1 (0.64) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL15420019 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL11581471 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL1006851 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL17329136 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL14912846 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL3227893 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL18725338 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL2210248 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethyl Acetate SCHEMBL631255 | 0.82 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MGAMGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101842361-A | Pyrazinone derivatives and their use in the treatment of lung diseases | ASTRAZENECA AB | 2010-09-22 | — | — | CN | disclosed |
| EP-0162695-B1 | 6-OXYGENATED-1,3,,4,5-TETRAHYDROBENZ(CD)INDOL-4-AMINES | SMITHKLINE BEECHAM CORPORATION (US) | 1990-01-17 | — | — | EP | disclosed |
| EP-0162695-A1 | 6-Oxygenated-1,3,,4,5-Tetrahydrobenz(cd)indol-4-amines | SMITHKLINE BEECHAM CORPORATION (US) | 1985-11-27 | — | — | EP | disclosed |