Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 2/20 | 0.61 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.61 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.54 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.54 |
| ▸ | AURKA | O14965 | 1/20 | 0.54 |
| ▸ | ATR | Q13535 | 8/20 | 0.52 |
| ▸ | ATRIP | Q8WXE1 | 8/20 | 0.52 |
| ▸ | CHEK1 | O14757 | 7/20 | 0.52 |
| ▸ | PDCD1 | Q15116 | 7/20 | 0.52 |
| ▸ | CD274 | Q9NZQ7 | 7/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.48 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.46 |
| ▸ | MTOR | P42345 | 3/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.44 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21516848 | 0.92 | CRHBP (0.55) | CRHBPCRHR2PDPK1ROCK1AURKB | |
| SCHEMBL21516206 | 0.92 | CRHBP (0.55) | CRHBPCRHR2PDPK1ROCK1AURKB | |
| SCHEMBL3083698 | 0.91 | PDPK1 (0.58) | CRHBPCRHR2PDPK1ROCK1AURKB | |
| SCHEMBL1318430 | 0.84 | CYP1A2 (0.60) | PDPK1ROCK1AURKBAURKAATR | |
| SCHEMBL20797863 | 0.82 | ATR (0.48) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL2513264 | 0.82 | ATR (0.48) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL2450233 | 0.82 | CRHBP (0.57) | CRHBPCRHR2PDPK1ROCK1AURKB | |
| SCHEMBL22873612 | 0.80 | ATR (0.49) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL24175032 | 0.79 | ATR (0.48) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL5791956 | 0.79 | CRHBP (0.55) | CRHBPCRHR2PDPK1AURKBSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2362775-A1 | CHEMICAL COMPOUNDS | GlaxoSmithKline LLC (US) | 2011-09-07 | — | — | EP | disclosed |