Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 3/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.35 |
| ▸ | CDC42BPB | Q9Y5S2 | 3/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5468542 | 1.00 | ROCK2 (0.35) | ROCK2ROCK1CDC42BPBOPRK1CHEK1 | |
| SCHEMBL5468546 | 1.00 | ROCK2 (0.35) | ROCK2ROCK1CDC42BPBOPRK1CHEK1 | |
| SCHEMBL5469398 | 0.82 | RAB9A (0.41) | OPRK1CHEK1ALDH1A1LMNACNR1 | |
| SCHEMBL5324440 | 0.82 | RAB9A (0.41) | OPRK1CHEK1ALDH1A1LMNACNR1 | |
| SCHEMBL5468309 | 0.75 | CNR1 (0.41) | OPRK1ALDH1A1CNR1BTKCCR1 | |
| SCHEMBL5321509 | 0.74 | SMN1; SMN2 (0.42) | OPRK1F10LMNACNR1KMT2A | |
| SCHEMBL5321515 | 0.74 | SMN1; SMN2 (0.42) | OPRK1F10LMNACNR1KMT2A | |
| SCHEMBL27009114 | 0.72 | F10 (0.39) | CHEK1F10ALDH1A1LMNATSHR | |
| SCHEMBL27009296 | 0.72 | F10 (0.39) | CHEK1F10ALDH1A1LMNATSHR | |
| SCHEMBL5475241 | 0.71 | PER2 (0.38) | CHEK1F10BTKCCR1CCR2 |
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-2007103719-A2 | MODULATORS OF 11-β HYDROXYL STEROID DEHYDROGENASE TYPE 1, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME | INCYTE CORPORATION (US) | 2007-09-13 | — | — | WO | disclosed |