Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | APP | P05067 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2591565 | 0.86 | ACACB (0.53) | ACACBRAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL2589683 | 0.79 | ACACB (0.55) | ACACBRAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL2592883 | 0.77 | LTA4H (0.48) | ACACBRAB9ANPC1MAPTSMN1; SMN2 | |
| SCHEMBL22131946 | 0.76 | ACACB (0.60) | ACACBRAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL2583763 | 0.76 | SCD (0.47) | ACACBRAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL2591931 | 0.76 | RAB9A (0.48) | ACACBRAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL2591241 | 0.75 | ACACB (0.53) | ACACBRAB9ANPC1 | |
| SCHEMBL13071510 | 0.74 | RAB9A (0.54) | ACACBRAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL2583770 | 0.73 | ACACB (0.46) | ACACBRAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL2591420 | 0.72 | ACACB (0.48) | ACACBRAB9ANPC1MAPTALDH1A1 |
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-3670496-A2 | ACC2 INHIBITORS | Shionogi&Co., Ltd. (JP) | 2020-06-24 | — | — | EP | disclosed |