Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 7/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 6/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| Acetic Acid Butyl Ester SCHEMBL14969 | 0.74 | — | — | |
| Acetic Acid Butyl Ester SCHEMBL28984633 | 0.74 | ALDH1A1 (1.00) | ALDH1A1ATMTSHRTDP1L3MBTL1 | |
| Acetic Acid Butyl Ester SCHEMBL28960923 | 0.74 | ALDH1A1 (1.00) | ALDH1A1ATMTSHRTDP1L3MBTL1 | |
| Acetic Acid Butyl Ester SCHEMBL1350194 | 0.74 | — | — | |
| Acetic Acid Butyl Ester SCHEMBL8026335 | 0.74 | ALDH1A1 (1.00) | ALDH1A1ATMTSHRTDP1L3MBTL1 | |
| SCHEMBL9066776 | 0.74 | — | — | |
| Acetamide SCHEMBL28790430 | 0.73 | LMNA (0.35) | LMNA | |
| Acetic Acid Butyl Ester SCHEMBL27934470 | 0.72 | ALDH1A1 (0.86) | ALDH1A1ATMTSHRTDP1L3MBTL1 | |
| Acetic Acid Butyl Ester SCHEMBL6910715 | 0.72 | ALDH1A1 (0.86) | ALDH1A1ATMTSHRTDP1L3MBTL1 | |
| Acetic Acid Butyl Ester SCHEMBL10649187 | 0.72 | — | — |
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-4204501-A1 | SOLVENT-BORNE, TWO-PACK, ANTICORROSION COATING COMPOSITION | BASF Coatings GmbH (DE) | 2023-07-05 | — | — | EP | disclosed |