Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 7/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAP2 | P11137 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9307944 | 0.86 | NPC1 (0.38) | ALDH1A1KDM4ETP53GAAHPGD | |
| SCHEMBL9150777 | 0.72 | SMN1; SMN2 (0.45) | ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL9309157 | 0.69 | FPR1 (0.39) | ALDH1A1KDM4EGAAHSD17B10CYP1A2 | |
| SCHEMBL9150343 | 0.69 | GAA (0.46) | ALDH1A1KDM4ETP53GAAHPGD | |
| SCHEMBL9155007 | 0.68 | NQO1 (0.46) | ALDH1A1KDM4ETP53GAAHPGD | |
| SCHEMBL9153940 | 0.68 | MAOB (0.43) | ALDH1A1KDM4ETP53GAAHPGD | |
| SCHEMBL9155117 | 0.67 | NPC1 (0.42) | — | |
| SCHEMBL6552186 | 0.67 | CES2 (0.45) | ALDH1A1MAPK14 | |
| SCHEMBL9307949 | 0.66 | TP53 (0.39) | ALDH1A1KDM4ETP53GAAHPGD | |
| SCHEMBL6940744 | 0.66 | NPC1 (0.42) | — |
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-0514546-A1 | CHROMENE DERIVATIVES, THEIR PRODUCTION AND USE. | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1992-11-25 | — | — | EP | disclosed |
| WO-1991012249-A1 | CHROMENE DERIVATIVES, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1991-08-22 | — | — | WO | disclosed |