Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EIF2AK2 | P19525 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CDK1 | P06493 | 7/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 7/20 | 0.49 |
| ▸ | CDK4 | P11802 | 4/20 | 0.49 |
| ▸ | CDK2 | P24941 | 4/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.49 |
| ▸ | CCND1 | P24385 | 3/20 | 0.49 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.45 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.45 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 4/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.43 |
| ▸ | JUN | P05412 | 2/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CCND3 | P30281 | 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 | |
|---|---|---|---|---|
| SCHEMBL4424686 | 0.83 | CDK4 (0.48) | EIF2AK2GAAHPGDTSHRCDK4 | |
| SCHEMBL8323680 | 0.80 | GAA (0.46) | GAAHPGDTSHRCDK4CDK2 | |
| SCHEMBL8316804 | 0.79 | CDK4 (0.59) | EIF2AK2CDK4CDK2ALDH1A1JAK2 | |
| SCHEMBL4425029 | 0.78 | EIF2AK2 (0.46) | EIF2AK2HPGDTSHRCDK4CDK2 | |
| SCHEMBL4425032 | 0.78 | EIF2AK2 (0.46) | EIF2AK2HPGDTSHRCDK4CDK2 | |
| SCHEMBL8317365 | 0.77 | CDK2 (0.60) | EIF2AK2CDK4CDK2ALDH1A1ALK | |
| SCHEMBL8317316 | 0.77 | CDK2 (0.74) | EIF2AK2CDK4CDK2ALDH1A1LMNA | |
| SCHEMBL1033568 | 0.77 | CDK1 (0.52) | CDK1CCNB1CDK4CDK2CCNA2 | |
| SCHEMBL8324564 | 0.75 | CDK4 (0.66) | EIF2AK2CDK4CDK2KDR | |
| SCHEMBL8325791 | 0.74 | CDK2 (0.56) | CDK4CDK2KDRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7456190-B2 | Compositions useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-11-25 | — | — | US | disclosed |
| US-7456190-B2 | Compositions useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-11-25 | — | — | US | disclosed |
| WO-2004083203-A1 | COMPOSITIONS USEFUL AS PROTEIN KINASE INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2004-09-30 | — | — | WO | disclosed |