Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 12/20 | 0.57 |
| ▸ | PLK4 | O00444 | 8/20 | 0.57 |
| ▸ | FLT3 | P36888 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | GSK3B | P49841 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1974392 | 1.00 | AURKB (0.57) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL1976316 | 1.00 | AURKB (0.57) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL1975208 | 1.00 | AURKB (0.57) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL1972573 | 1.00 | AURKB (0.57) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL1973511 | 0.85 | AURKB (0.57) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL1973655 | 0.85 | PLK4 (0.49) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL1975786 | 0.85 | PLK4 (0.49) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL1972624 | 0.85 | AURKB (0.57) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL1974009 | 0.84 | AURKB (0.60) | AURKBPLK4FLT3CYP2C19GSK3B | |
| SCHEMBL14547305 | 0.83 | PLK4 (0.49) | AURKBPLK4FLT3CYP2C19GSK3B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2509946-A1 | SPIRO INDOLE - CYCLOPROPANE INDOLINONES USEFUL AS AMPK MODULATORS | F. Hoffmann-La Roche AG (CH) | 2012-10-17 | — | — | EP | disclosed |
| WO-2011070039-A1 | SPIRO INDOLE - CYCLOPROPANE INDOLINONES USEFUL AS AMPK MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-06-16 | — | — | WO | disclosed |
| WO-2011069298-A1 | NOVEL CYCLOPROPANE INDOLINONE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-06-16 | — | — | WO | disclosed |