Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 3/20 | 0.40 |
| ▸ | CPT2 | P23786 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HMGCR | P04035 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.31 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2585317 | 0.77 | ACLY (0.38) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| SCHEMBL2422807 | 0.74 | ACLY (0.46) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| SCHEMBL26056411 | 0.74 | ACLY (0.46) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| SCHEMBL5793304 | 0.71 | ACLY (0.45) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| Ammonia Solution, Strong SCHEMBL28362777 | 0.71 | CPT2 (0.33) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| SCHEMBL4442944 | 0.68 | SLC22A6 (0.43) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| SCHEMBL8436127 | 0.67 | ALDH1A1 (0.43) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| SCHEMBL11507546 | 0.67 | ALDH1A1 (0.43) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| SCHEMBL10940349 | 0.67 | HMGCR (0.50) | ACLYCPT2ALDH1A1HMGCRCHRM1 | |
| SCHEMBL10520915 | 0.65 | TDP1 (0.43) | ACLYCPT2ALDH1A1HMGCRCHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0058236-B1 | DIACYLOXYALKADIENES AND THEIR PREPARATION | BASF Aktiengesellschaft (DE) | 1984-04-25 | — | — | EP | disclosed |
| EP-0058236-A1 | Diacyloxyalkadienes and their preparation | BASF Aktiengesellschaft (DE) | 1982-08-25 | — | — | EP | disclosed |
| 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 |