Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 3/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | BCR | P11274 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 5/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 2/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.34 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.33 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.33 |
| ▸ | PTK6 | Q13882 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4724082 | 0.94 | TBK1 (0.38) | TBK1CDK4ABL1GPR119ACACB | |
| SCHEMBL4719875 | 0.92 | MKNK1 (0.39) | TBK1CDK4GPR119CDK2ACACB | |
| SCHEMBL4763290 | 0.91 | TBK1 (0.40) | TBK1CDK4GPR119CDK2ACACB | |
| SCHEMBL4723287 | 0.91 | TBK1 (0.39) | TBK1CDK4GPR119CDK2ACACB | |
| SCHEMBL4723185 | 0.90 | TBK1 (0.38) | TBK1ABL1GPR119ACACBPTK6 | |
| SCHEMBL4724030 | 0.90 | KDR (0.39) | TBK1ABL1BCRLCKFGFR4 | |
| SCHEMBL4723214 | 0.89 | ERBB2 (0.39) | TBK1LCKPTK6 | |
| SCHEMBL4722378 | 0.89 | TBK1 (0.37) | TBK1CDK4GPR119CDK2ACACB | |
| SCHEMBL4722370 | 0.89 | TBK1 (0.39) | TBK1CDK4GPR119CDK2ACACB | |
| SCHEMBL387995 | 0.88 | GPR119 (0.47) | TBK1GPR119CYP3A4CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1756084-B1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO | ARENA PHARM INC (US) | 2008-11-26 | — | — | EP | claimed |