Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 4/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.53 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.53 |
| ▸ | AURKA | O14965 | 1/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | PRKACA | P17612 | 1/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.53 |
| ▸ | ABL1 | P00519 | 3/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.52 |
| ▸ | PRKCA | P17252 | 1/20 | 0.52 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.52 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.51 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.51 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.51 |
| ▸ | CAMKK2 | Q96RR4 | 6/20 | 0.50 |
| ▸ | GSK3B | P49841 | 2/20 | 0.50 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.49 |
| ▸ | BCR | P11274 | 2/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL27616816 | 0.84 | ABL1 (0.55) | IKBKBHDAC1MAPK8MAPK10PRKACA | |
| SCHEMBL7472390 | 0.80 | KDM4E (0.48) | IKBKBHDAC1MAPK8MAPK10ADORA2A | |
| SCHEMBL1593016 | 0.78 | PRKCD (0.79) | IKBKBMAPK8MAPK10AURKAABL1 | |
| SCHEMBL7601457 | 0.77 | ABL1 (0.78) | PRKACAABL1EGFRPRKCAPIK3CG | |
| SCHEMBL8401982 | 0.77 | MAPK10 (0.55) | HDAC1MAPK10EGFR | |
| Hydrochloric Acid SCHEMBL5205211 | 0.76 | ABL1 (0.76) | PRKACAABL1EGFRPRKCAPIK3CG | |
| SCHEMBL1231313 | 0.76 | ABL1 (0.59) | IKBKBMAPK8MAPK10PRKACAABL1 | |
| SCHEMBL11471935 | 0.76 | AGTR1 (0.63) | IKBKBMAPK8MAPK10AURKAHSP90AA1 | |
| SCHEMBL4386919 | 0.75 | ABL1 (0.82) | IKBKBMAPK8MAPK10PRKACAABL1 | |
| SCHEMBL19554066 | 0.74 | ABL1 (0.66) | HDAC1HSP90AA1PRKACAABL1EGFR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1979329-A2 | 4-ARYL-2-AMINO-PYRIMIDINES OR 4-ARYL-2-AMINOALKYL-PYRIMIDINES AS JAK-2 MODULATORS AND METHODS OF USE | Exelixis, Inc. (US) | 2008-10-15 | — | — | EP | disclosed |
| WO-2007089768-A2 | 4-ARYL-2-AMINO-PYRIMIDINES OR 4-ARYL-2-AMINOALKYL-PYRIMIDINES AS JAK-2 MODULATORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | EXELIXIS, INC. (US) | 2007-08-09 | — | — | WO | disclosed |