Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.44 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7749197 | 0.92 | ALDH1A1 (0.56) | MAPTALDH1A1CYP3A4LMNAHSD17B10 | |
| SCHEMBL7857412 | 0.83 | ALDH1A1 (0.67) | MAPTALDH1A1CYP3A4LMNAHSD17B10 | |
| SCHEMBL570395 | 0.83 | ALDH1A1 (0.66) | MAPTALDH1A1LMNATSHRMAPK1 | |
| SCHEMBL16884182 | 0.81 | ESR1 (0.65) | MAPTALDH1A1CYP3A4LMNAHSD17B10 | |
| SCHEMBL5167985 | 0.80 | CA12 (0.63) | MAPTALDH1A1CYP3A4LMNATSHR | |
| SCHEMBL21237905 | 0.80 | ADRB2 (0.55) | MAPTCA2CA12CA1ESR1 | |
| SCHEMBL19758999 | 0.80 | ALDH1A1 (0.73) | MAPTALDH1A1CYP3A4LMNAHSD17B10 | |
| SCHEMBL8442833 | 0.79 | CYP3A4 (0.66) | MAPTALDH1A1CYP3A4LMNAHSD17B10 | |
| SCHEMBL110051 | 0.79 | ALDH1A1 (0.64) | MAPTALDH1A1TSHRCA2CA12 | |
| SCHEMBL21025582 | 0.79 | ALDH1A1 (0.56) | MAPTALDH1A1LMNATSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7208545-B1 | Selected cyclohexane -1,3-and -1,4-dicarboxylic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2007-04-24 | — | — | US | claimed |
| EP-1194396-B1 | SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS | BASF AG (DE) | 2005-11-09 | — | — | EP | claimed |
| US-7208545-B1 | Selected cyclohexane -1,3-and -1,4-dicarboxylic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2007-04-24 | — | — | US | disclosed |