Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 7/20 | 0.35 |
| ▸ | ACACA | Q13085 | 7/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.31 |
| ▸ | HPGD | P15428 | 4/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.31 |
| ▸ | RAB9A | P51151 | 5/20 | 0.31 |
| ▸ | MAPT | P10636 | 4/20 | 0.31 |
| ▸ | NPC1 | O15118 | 4/20 | 0.31 |
| ▸ | USP28 | Q96RU2 | 3/20 | 0.31 |
| ▸ | USP25 | Q9UHP3 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 3/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3492698 | 0.91 | ACACB (0.34) | ACACBACACAIKBKBLIMK1ALDH1A1 | |
| SCHEMBL3494981 | 0.91 | ACACB (0.35) | ACACBACACAIKBKBLIMK1ALDH1A1 | |
| SCHEMBL3493700 | 0.91 | ALDH1A1 (0.40) | ACACBACACAIKBKBLIMK1ALDH1A1 | |
| SCHEMBL3492562 | 0.89 | MAPT (0.36) | ACACBACACAIKBKBLIMK1ALDH1A1 | |
| SCHEMBL3494572 | 0.89 | SMN1; SMN2 (0.33) | ACACBACACAIKBKBLIMK1ALDH1A1 | |
| SCHEMBL13367513 | 0.88 | NPC1 (0.35) | ACACBACACAIKBKBLIMK1ALDH1A1 | |
| SCHEMBL3494006 | 0.86 | ACACB (0.35) | ACACBACACAIKBKBLIMK1ALDH1A1 | |
| SCHEMBL13367438 | 0.85 | ACACB (0.51) | ACACBACACA | |
| SCHEMBL3493125 | 0.82 | PDE4B (0.33) | ACACBACACAHPGDRAB9AMAPT | |
| SCHEMBL3492147 | 0.81 | ACACB (0.41) | ACACBACACAIKBKBLIMK1HPGD |
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-2123652-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2009-11-25 | — | — | EP | disclosed |