Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.38 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7568143 | 1.00 | CES2 (0.59) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL28752539 | 0.98 | CES2 (0.63) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL7570269 | 0.82 | CES2 (0.50) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL8469575 | 0.81 | CES2 (0.65) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL8092040 | 0.81 | CES2 (0.65) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL7455105 | 0.81 | CES2 (0.65) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL27723040 | 0.80 | HTT (0.47) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL96284 | 0.80 | CES2 (0.64) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL28146389 | 0.80 | HTT (0.56) | CES2HTTMEN1THRBKMT2A | |
| SCHEMBL28185613 | 0.79 | EPHX2 (0.58) | CES2HTTMEN1THRBKMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0042098-A2 | Process for the preparation of 1-butene-3,4-diolemonoesters and 1-butene-3-alkyl-3,4-diolemonoesters | BASF Aktiengesellschaft (DE) | 1981-12-23 | — | — | EP | disclosed |