Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.61 |
| ▸ | ACACB | O00763 | 1/20 | 0.59 |
| ▸ | ACACA | Q13085 | 1/20 | 0.59 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.45 |
| ▸ | PPARA | Q07869 | 8/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | CPT2 | P23786 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.40 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10872185 | 1.00 | ACLY (0.61) | ACLYACACBACACATBXAS1PPARA | |
| SCHEMBL28527574 | 1.00 | ACLY (0.61) | ACLYACACBACACATBXAS1PPARA | |
| SCHEMBL10869000 | 1.00 | ACLY (0.61) | ACLYACACBACACATBXAS1PPARA | |
| SCHEMBL10870601 | 0.98 | ACLY (0.57) | ACLYACACBACACATBXAS1PPARA | |
| SCHEMBL1132524 | 0.91 | ACLY (0.54) | ACLYACACBACACATBXAS1PPARA | |
| Hydrochloric Acid SCHEMBL6275324 | 0.88 | ACLY (0.52) | ACLYACACBACACATBXAS1PPARA | |
| SCHEMBL5528331 | 0.88 | ACLY (0.74) | ACLYACACBACACATBXAS1PPARA | |
| SCHEMBL9177458 | 0.88 | ACLY (0.74) | ACLYACACBACACATBXAS1PPARA | |
| SCHEMBL20474799 | 0.88 | ACLY (0.74) | ACLYACACBACACATBXAS1PPARA | |
| SCHEMBL1836313 | 0.88 | ACLY (0.74) | ACLYACACBACACATBXAS1PPARA |
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-0186083-A2 | N-(2-Hyxdroxyalkyl)-amino acids and their derivatives, process for their preparation and pharmaceutical compositions containing them | ASTA Pharma AG (DE) | 1986-07-02 | — | — | EP | disclosed |