Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NTSR1 | P30989 | 6/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | CASR | P41180 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3505352 | 0.83 | LMNA (0.42) | LMNAGRM4ALDH1A1GAAPKM | |
| SCHEMBL3504376 | 0.79 | GRM4 (0.41) | LMNAGRM4ALDH1A1GAAHSP90AA1 | |
| SCHEMBL3505500 | 0.77 | ALDH1A1 (0.43) | ALDH1A1 | |
| SCHEMBL3510103 | 0.77 | HSP90AA1 (0.41) | LMNAGRM4ALDH1A1GAAHSP90AA1 | |
| SCHEMBL6957700 | 0.75 | DRD3 (0.45) | ALDH1A1GAA | |
| SCHEMBL3508760 | 0.72 | HTR2A (0.39) | ALDH1A1CASR | |
| SCHEMBL3505067 | 0.71 | ACHE (0.40) | LMNAGRM4ALDH1A1GAA | |
| SCHEMBL8947062 | 0.70 | ACHE (0.42) | LMNAALDH1A1GAA | |
| SCHEMBL9085384 | 0.69 | POLB (0.47) | LMNAGRM4ALDH1A1CASR | |
| SCHEMBL6951008 | 0.69 | HRH3 (0.41) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1994012495-A1 | SUBSTITUTED 3-(AMINOALKYLAMINO)-1,2-BENZISOXAZOLES AND RELATED COMPOUNDS | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-06-09 | — | — | WO | disclosed |