Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OTUD7B | Q6GQQ9 | 2/20 | 0.45 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.40 |
| ▸ | IP6K1 | Q92551 | 3/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 3/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17436019 | 0.82 | ALDH1A1 (0.47) | PDK2HPGDHTTSMN1; SMN2 | |
| SCHEMBL17436008 | 0.81 | RARB (0.44) | HTT | |
| SCHEMBL17444524 | 0.81 | KDM1A (0.43) | MAPK14PDK2IP6K1PDE4BTSHR | |
| SCHEMBL17436294 | 0.77 | ALDH1A1 (0.45) | PDK2HPGDHTTSMN1; SMN2 | |
| SCHEMBL31390939 | 0.75 | MAPK14 (0.43) | MAPK14PDK2IP6K1TSHR | |
| SCHEMBL22058140 | 0.73 | KDM1A (0.40) | MAPK14PDK2IP6K1TSHR | |
| Bromide SCHEMBL20954964 | 0.72 | KDM1A (0.39) | MAPK14PDK2IP6K1TSHR | |
| SCHEMBL30468541 | 0.72 | TSHR (0.40) | MAPK14PDK2IP6K1TSHRSMN1; SMN2 | |
| SCHEMBL17436068 | 0.71 | PKM (0.50) | PDE4BHPGD | |
| SCHEMBL19058553 | 0.71 | TNKS (0.33) | — |
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-3169681-A1 | NOVEL SUBSTITUTED PYRIMIDINE COMPOUNDS | Grünenthal GmbH (DE) | 2017-05-24 | — | — | EP | disclosed |
| WO-2016008593-A1 | NOVEL SUBSTITUTED PYRIMIDINE COMPOUNDS | Grünenthal GmbH (DE) | 2016-01-21 | — | — | WO | disclosed |