Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 3/20 | 0.37 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.36 |
| ▸ | CLK1 | P49759 | 1/20 | 0.36 |
| ▸ | CLK2 | P49760 | 1/20 | 0.36 |
| ▸ | CLK3 | P49761 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | DYRK4 | Q9NR20 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12730329 | 0.81 | SMN1; SMN2 (0.37) | CRHR1TSHRLMNAHPGDFAAH | |
| SCHEMBL12831727 | 0.81 | TSHR (0.42) | CRHR1TSHRLMNAHPGDFAAH | |
| SCHEMBL4081070 | 0.79 | CSNK1E (0.36) | CRHR1GSK3BCSNK1ECLK1CLK2 | |
| SCHEMBL12913620 | 0.72 | CASR (0.43) | GSK3BTSHRLMNAHPGDFAAH | |
| SCHEMBL13885373 | 0.72 | GSK3B (0.32) | CRHR1GSK3BCSNK1ECLK1CLK2 | |
| SCHEMBL2854775 | 0.71 | HSD17B10 (0.57) | GSK3BTSHRLMNAHPGDMAPT | |
| SCHEMBL5455913 | 0.69 | PRMT5 (0.60) | CRHR1TSHRLMNAHPGDFAAH | |
| SCHEMBL30442326 | 0.68 | GSK3B (0.41) | GSK3BCSNK1ECLK1CLK2CLK3 | |
| SCHEMBL25047039 | 0.67 | HTT (0.56) | TSHRLMNAMAPTMAPK1ALDH1A1 | |
| SCHEMBL13377500 | 0.67 | ALDH1A1 (0.56) | GSK3BTSHRLMNAHPGDMAPT |
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-2011038293-A1 | CYCLIC PEPTIDE INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2011-03-31 | — | — | WO | disclosed |