Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.66 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.66 |
| ▸ | BCR | P11274 | 1/20 | 0.66 |
| ▸ | SRC | P12931 | 1/20 | 0.66 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.66 |
| ▸ | JAK2 | O60674 | 2/20 | 0.54 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.49 |
| ▸ | PLK1 | P53350 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1030447 | 0.80 | MAPK14 (0.52) | JAK2DGAT1GSK3BMAPK8PIK3CG | |
| SCHEMBL29131118 | 0.80 | JAK2 (0.61) | ABL1PDGFRBBCRSRCPDGFRA | |
| SCHEMBL30668832 | 0.80 | JAK2 (0.61) | ABL1PDGFRBBCRSRCPDGFRA | |
| SCHEMBL1033626 | 0.79 | CDK1 (0.53) | JAK2DGAT1KDM4EGSK3BMAPK8 | |
| SCHEMBL1365 | 0.79 | ABL1 (1.00) | ABL1PDGFRBBCRSRCPDGFRA | |
| SCHEMBL1033986 | 0.79 | PTK2 (0.49) | ABL1PDGFRBBCRSRCPDGFRA | |
| SCHEMBL1034632 | 0.78 | HDAC8 (0.51) | ABL1PDGFRBBCRSRCPDGFRA | |
| SCHEMBL1034808 | 0.78 | AURKA (0.55) | DGAT1HPGDSMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL1034911 | 0.77 | ROCK2 (0.57) | JAK2DGAT1GSK3BMAPK1AURKA | |
| SCHEMBL3619159 | 0.77 | ADORA1 (0.59) | JAK2DGAT1ADORA1PLK1GSK3B |
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-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 |
| WO-2010151747-A1 | PYRIMINE COMPOUNDS AND METHODS OF MAKING AND USING SAME | CYSTIC FIBROSIS FOUNDATION THERAPEUTICS, INC. (US) | 2010-12-29 | — | — | WO | disclosed |