Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNK2 | Q07912 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 6/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3921909 | 0.86 | TNK2 (0.42) | TNK2HSD17B10KCNH2SCN9APOLB | |
| SCHEMBL27643649 | 0.82 | MDM2 (0.43) | SCN9AMDM2HCRTR1HCRTR2 | |
| SCHEMBL4371560 | 0.79 | ALDH1A1 (0.48) | TNK2HSD17B10KCNH2SCN9APOLB | |
| SCHEMBL4371558 | 0.79 | ALDH1A1 (0.48) | TNK2HSD17B10KCNH2SCN9APOLB | |
| SCHEMBL4372532 | 0.79 | ALDH1A1 (0.48) | TNK2HSD17B10KCNH2SCN9APOLB | |
| SCHEMBL4371432 | 0.77 | CNR1 (0.42) | HSD17B10MDM2ALDH1A1KDM4EHTT | |
| SCHEMBL4375154 | 0.75 | PTGER1 (0.43) | HSD17B10POLBALDH1A1GAAHTT | |
| SCHEMBL3921031 | 0.74 | CNR1 (0.40) | MDM2 | |
| SCHEMBL4368746 | 0.74 | CNR2 (0.46) | HSD17B10POLBALDH1A1KDM4EGAA | |
| SCHEMBL4382166 | 0.73 | ALDH1A1 (0.47) | TNK2HSD17B10KCNH2SCN9APOLB |
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-1583742-A1 | NOVEL CB 1 RECEPTOUR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-10-12 | — | — | EP | disclosed |
| WO-2004060870-A1 | NOVEL CB 1 RECEPTOUR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-07-22 | — | — | WO | disclosed |