Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | GCGR | P47871 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL16446636 | 0.86 | GCGR (0.30) | GCGRKDM4E | |
| SCHEMBL9479909 | 0.76 | — | — | |
| SCHEMBL4273858 | 0.74 | TSHR (0.33) | TSHR | |
| SCHEMBL13828637 | 0.71 | HTT (0.34) | KDM4EALDH1A1 | |
| SCHEMBL21260512 | 0.68 | HPGD (0.37) | NPSR1GCGRKDM4EALDH1A1GAA | |
| SCHEMBL4990413 | 0.67 | GCGR (0.41) | GCGRKDM4EALDH1A1 | |
| SCHEMBL12495542 | 0.67 | CASP1 (0.37) | SMN1; SMN2TSHRNPSR1KDM4EALDH1A1 | |
| SCHEMBL4992983 | 0.66 | GCGR (0.40) | GCGRKDM4EALDH1A1 | |
| SCHEMBL28787586 | 0.66 | MAPT (0.36) | SMN1; SMN2NPSR1GCGRKDM4EALDH1A1 | |
| SCHEMBL25085500 | 0.65 | GCGR (0.33) | GCGRKDM4EALDH1A1GAAHPGD |
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-2016003827-A2 | FUSED CYCLOALKYL-PYRIMIDINE COMPOUNDS AND USES THEREOF | MEDIVATION TECHNOLOGIES, INC. (US) | 2016-01-07 | — | — | WO | disclosed |