Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.62 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.44 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | SELP | P16109 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.36 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SLCO2B1 | O94956 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13679672 | 0.94 | ABCB1 (0.56) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL13679678 | 0.94 | ABCB1 (0.63) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL719430 | 0.92 | ABCB1 (0.67) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL719429 | 0.92 | ABCB1 (0.67) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL3824112 | 0.86 | ABCB1 (0.60) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL718305 | 0.86 | ABCB1 (0.68) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL16448288 | 0.86 | ABCB1 (0.68) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL4442576 | 0.82 | ABCB1 (0.53) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL4442578 | 0.82 | ABCB1 (0.53) | ABCB1SIRT2SIRT1ALOX5PTPN1 | |
| SCHEMBL13679694 | 0.81 | ABCB1 (0.40) | ABCB1SIRT2SIRT1MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0999835-B1 | IMIDAZOLE DERIVATIVES AS MDR MODULATORS | TAIJI BIOMEDICAL INC (US) | 2009-09-09 | — | — | EP | disclosed |
| EP-2082740-A2 | Use of imidazole derivatives as MDR modulators | Taiji Biomedical, Inc. (US) | 2009-07-29 | — | — | EP | disclosed |