Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.56 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SELP | P16109 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL13679697 | 0.94 | ABCB1 (0.62) | ABCB1NOX1ALOX5SIRT2SIRT1 | |
| SCHEMBL3824112 | 0.93 | ABCB1 (0.60) | ABCB1NOX1ALOX5SIRT2SIRT1 | |
| SCHEMBL6625154 | 0.88 | ABCB1 (0.69) | ABCB1NOX1ALOX5SIRT2SIRT1 | |
| SCHEMBL13679678 | 0.88 | ABCB1 (0.63) | ABCB1ALOX5SIRT2SIRT1MAPT | |
| SCHEMBL719430 | 0.86 | ABCB1 (0.67) | ABCB1NOX1ALOX5SIRT2SIRT1 | |
| SCHEMBL719429 | 0.86 | ABCB1 (0.67) | ABCB1NOX1ALOX5SIRT2SIRT1 | |
| SCHEMBL13780561 | 0.84 | NOX1 (0.62) | NOX1ALOX5SLC2A1SIRT2SIRT1 | |
| SCHEMBL3828912 | 0.82 | ABCB1 (0.69) | ABCB1NOX1ALOX5SIRT2SIRT1 | |
| SCHEMBL13679695 | 0.81 | NOX1 (0.45) | NOX1ALOX5SLC2A1SIRT2SIRT1 | |
| SCHEMBL16448288 | 0.81 | ABCB1 (0.68) | ABCB1NOX1ALOX5SIRT2SIRT1 |
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 |