Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | ALPL | P05186 | 1/20 | 0.41 |
| ▸ | KYAT1 | Q16773 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL277081 | 0.98 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1TDP1GAACYP19A1 | |
| SCHEMBL14338895 | 0.88 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1TDP1GAACYP19A1 | |
| SCHEMBL327682 | 0.84 | TSHR (0.43) | SMN1; SMN2ALDH1A1TDP1GAACYP1A2 | |
| SCHEMBL25179993 | 0.83 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1TDP1GAACYP19A1 | |
| SCHEMBL2858714 | 0.83 | MAPT (0.49) | SMN1; SMN2ALDH1A1TDP1GAACYP1A2 | |
| SCHEMBL2117704 | 0.83 | KMT2A (0.49) | SMN1; SMN2ALDH1A1TDP1GAAKYAT1 | |
| SCHEMBL1741190 | 0.83 | ALDH1A1 (0.53) | SMN1; SMN2ALDH1A1CYP19A1HTR2AHTT | |
| SCHEMBL2848362 | 0.82 | SMN1; SMN2 (0.47) | SMN1; SMN2ALDH1A1TDP1GAACYP19A1 | |
| SCHEMBL2852255 | 0.82 | HDAC3 (0.48) | ALDH1A1TDP1CYP19A1CYP1A2HTT | |
| SCHEMBL14346527 | 0.81 | CA12 (0.36) | SMN1; SMN2ALDH1A1TDP1GAACYP19A1 |
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-2008062480-A2 | AN IMPROVED PROCESS FOR THE PREPARATION OF RIMONABANT | IND-SWIFT LABORATORIES LIMITED (IN) | 2008-05-29 | — | — | WO | disclosed |