Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.73 |
| ▸ | CREBBP | Q92793 | 7/20 | 0.44 |
| ▸ | BRD4 | O60885 | 7/20 | 0.44 |
| ▸ | EP300 | Q09472 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3916768 | 0.85 | ALDH1A1 (1.00) | ALDH1A1CREBBPBRD4EP300IDO1 | |
| SCHEMBL3919961 | 0.85 | ALDH1A1 (1.00) | ALDH1A1CREBBPBRD4EP300IDO1 | |
| SCHEMBL30863319 | 0.85 | ALDH1A1 (1.00) | ALDH1A1CREBBPBRD4EP300IDO1 | |
| SCHEMBL29990165 | 0.85 | ALDH1A1 (1.00) | ALDH1A1CREBBPBRD4EP300IDO1 | |
| SCHEMBL1843998 | 0.85 | ALDH1A1 (1.00) | ALDH1A1CREBBPBRD4EP300IDO1 | |
| SCHEMBL19960652 | 0.80 | ALDH1A1 (0.68) | ALDH1A1CREBBPBRD4EP300LMNA | |
| SCHEMBL25499650 | 0.79 | ALDH1A1 (0.62) | ALDH1A1CREBBPBRD4EP300IDO1 | |
| SCHEMBL12050556 | 0.75 | ALDH1A1 (0.57) | ALDH1A1CREBBPBRD4EP300IDO1 | |
| SCHEMBL30528072 | 0.75 | ALDH1A1 (0.57) | ALDH1A1CREBBPBRD4EP300IDO1 | |
| SCHEMBL8693351 | 0.75 | ALDH1A1 (0.62) | ALDH1A1CREBBPBRD4EP300IDO1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |
| WO-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |