Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 3/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | EED | O75530 | 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 | |
|---|---|---|---|---|
| SCHEMBL27732197 | 0.82 | TSHR (0.38) | DRD2LMNATP53HCRTR2 | |
| SCHEMBL27732170 | 0.79 | PRKCZ (0.36) | DRD2ALDH1A1ADRA1DADRA1AADRA1B | |
| SCHEMBL28770717 | 0.79 | KDM4E (0.35) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL27732180 | 0.77 | GAA (0.39) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL27732182 | 0.76 | KMT2A (0.37) | ALDH1A1LMNAHTTHCRTR2 | |
| SCHEMBL28774867 | 0.76 | MEN1 (0.36) | ALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL27732200 | 0.73 | HCAR1 (0.42) | HCRTR2 | |
| SCHEMBL27712215 | 0.72 | KMT2A (0.35) | ALDH1A1LMNAHTTHCRTR2 | |
| SCHEMBL28774865 | 0.71 | HCAR1 (0.36) | — | |
| SCHEMBL27712024 | 0.70 | MEN1 (0.37) | ALDH1A1LMNATP53HTTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101243050-B | Pyrazolone derivatives | HOFFMANN LA ROCHE | 2012-07-04 | — | — | CN | disclosed |
| CN-101243050-A | Pyrazolone derivatives | HOFFMANN LA ROCHE (CH) | 2008-08-13 | — | — | CN | disclosed |