Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 2/20 | 0.52 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.50 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5709322 | 0.91 | KEAP1 (0.46) | KEAP1GABBR2GABBR1CYP2C9MEN1 | |
| SCHEMBL3520190 | 0.86 | GABBR2 (0.63) | KEAP1GABBR2GABBR1CYP2C9MEN1 | |
| Hydrochloric Acid SCHEMBL11527826 | 0.84 | GABBR2 (0.61) | KEAP1GABBR2GABBR1CYP2C9MEN1 | |
| SCHEMBL22089315 | 0.83 | GABBR2 (0.50) | KEAP1GABBR2GABBR1CYP2C9MEN1 | |
| SCHEMBL15872203 | 0.81 | GAA (0.48) | KEAP1CYP2C9CYP2C19FFAR1CES2 | |
| SCHEMBL15872205 | 0.81 | GAA (0.48) | KEAP1CYP2C9CYP2C19FFAR1CES2 | |
| SCHEMBL6002264 | 0.80 | GABBR2 (0.58) | KEAP1GABBR2GABBR1CYP2C9MEN1 | |
| SCHEMBL15614165 | 0.80 | GABBR2 (0.58) | KEAP1GABBR2GABBR1CYP2C9MEN1 | |
| SCHEMBL7809416 | 0.79 | GABBR2 (0.47) | GABBR2GABBR1CYP2C9MEN1KMT2A | |
| SCHEMBL3030480 | 0.78 | FFAR1 (0.51) | KEAP1KMT2AFFAR1PPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1727785-A1 | PHENYL INDAN DERIVATIVES | H.Lundbeck A/S (DK) | 2006-12-06 | — | — | EP | disclosed |
| WO-2005087708-A1 | PHENYL INDAN DERIVATIVES | H. LUNDBECK A/S (DK) | 2005-09-22 | — | — | WO | disclosed |