Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK10 | P53779 | 4/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | IKBKB | O14920 | 3/20 | 0.45 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.44 |
| ▸ | MAPK9 | P45984 | 3/20 | 0.44 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.44 |
| ▸ | IDH1 | O75874 | 3/20 | 0.43 |
| ▸ | IDH2 | P48735 | 2/20 | 0.43 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.41 |
| ▸ | BCL6 | P41182 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1033717 | 0.91 | SMN1; SMN2 (0.48) | MAPK10SMN1; SMN2IKBKBMAPK8MAPK9 | |
| SCHEMBL1034516 | 0.88 | SMN1; SMN2 (0.60) | MAPK10SMN1; SMN2IKBKBMAPK8MAPK9 | |
| SCHEMBL1032136 | 0.87 | SMN1; SMN2 (0.62) | MAPK10SMN1; SMN2IKBKBMAPK8MAPK9 | |
| SCHEMBL3620677 | 0.87 | SMN1; SMN2 (0.62) | MAPK10SMN1; SMN2IKBKBMAPK8MAPK9 | |
| SCHEMBL3654146 | 0.86 | SMN1; SMN2 (0.53) | MAPK10SMN1; SMN2IKBKBMAPK8MAPK9 | |
| SCHEMBL12955857 | 0.86 | SMN1; SMN2 (0.53) | MAPK10SMN1; SMN2IKBKBMAPK8MAPK9 | |
| SCHEMBL1032761 | 0.80 | IKBKB (0.49) | MAPK10SMN1; SMN2IKBKBMAPK8MAPK9 | |
| SCHEMBL1031273 | 0.79 | HDAC8 (0.56) | HDAC8 | |
| SCHEMBL1074198 | 0.78 | IKBKB (0.47) | SMN1; SMN2IKBKBMAPK8MAPK9CDK4 | |
| SCHEMBL1032457 | 0.77 | NOS3 (0.55) | SMN1; SMN2IKBKBMAPK8MAPK9CDK4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010151747-A1 | PYRIMINE COMPOUNDS AND METHODS OF MAKING AND USING SAME | CYSTIC FIBROSIS FOUNDATION THERAPEUTICS, INC. (US) | 2010-12-29 | — | — | WO | claimed |
| WO-2011008931-A2 | ARYLPYRIMIDINE COMPOUNDS AND COMBINATION THERAPY COMPRISING SAME FOR TREATING CYSTIC FIBROSIS & RELATED DISORDERS | CYSTIC FIBROSIS FOUNDATION THERAPEUTICS, INC. (US) | 2011-01-20 | — | — | WO | disclosed |