Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.37 |
| ▸ | CRHBP | P24387 | 2/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | FLT4 | P35916 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL5032562 | 0.93 | CRHBP (0.36) | CYP3A4IRAK4CRHBPCRHR2TSHR | |
| SCHEMBL5034877 | 0.91 | CYP3A4 (0.44) | CYP3A4IRAK4KMT2AKDM4EL3MBTL1 | |
| SCHEMBL5035949 | 0.90 | CYP3A4 (0.42) | CYP3A4TSHRFLT1FLT4KDR | |
| SCHEMBL5035010 | 0.89 | CYP3A4 (0.39) | CYP3A4IRAK4CRHBPCRHR2TSHR | |
| SCHEMBL5041489 | 0.88 | CYP3A4 (0.41) | CYP3A4IRAK4CRHBPCRHR2TSHR | |
| SCHEMBL5036040 | 0.88 | LMNA (0.42) | CYP3A4HSP90AA1KMT2AALDH1A1GAA | |
| SCHEMBL5035199 | 0.87 | CYP3A4 (0.39) | CYP3A4IRAK4CRHBPCRHR2TSHR | |
| SCHEMBL5039107 | 0.87 | CYP3A4 (0.38) | CYP3A4TSHRFLT1FLT4KDR | |
| SCHEMBL5035948 | 0.86 | CYP3A4 (0.40) | CYP3A4CRHBPCRHR2TSHRFLT1 | |
| SCHEMBL5034908 | 0.85 | CYP3A4 (0.43) | CYP3A4KMT2AHTTMEN1MAPT |
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-1694673-B1 | THIAZOLE DERIVATES | HOFFMANN LA ROCHE (CH) | 2008-01-16 | — | — | EP | claimed |