Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1012581 | 0.76 | ACLY (0.54) | ACLYACACBACACATSHRALDH1A1 | |
| SCHEMBL9303118 | 0.76 | ACLY (0.39) | ACLYACACBACACATSHRALDH1A1 | |
| SCHEMBL9620057 | 0.73 | — | — | |
| SCHEMBL1551665 | 0.73 | — | — | |
| SCHEMBL7869505 | 0.73 | ALDH1A1 (0.33) | TSHRALDH1A1TP53 | |
| Formic Acid SCHEMBL6319703 | 0.73 | ACLY (0.50) | ACLYACACBACACATSHRALDH1A1 | |
| SCHEMBL28278982 | 0.73 | ACLY (0.36) | ACLYACACBACACATSHRALDH1A1 | |
| SCHEMBL28095353 | 0.73 | GGT1 (0.52) | ACLYACACBACACATSHRALDH1A1 | |
| SCHEMBL31470992 | 0.71 | TSHR (0.36) | ACLYACACBACACATSHRALDH1A1 | |
| SCHEMBL10554883 | 0.70 | CYP4F2 (0.38) | ACLYACACBACACATSHRALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2346836-A1 | PROCESSES FOR THE PREPARATION OF BENDAMUSTINE | Cephalon, Inc. (US) | 2011-07-27 | — | — | EP | disclosed |
| WO-2010042568-A1 | PROCESSES FOR THE PREPARATION OF BENDAMUSTINE | CEPHALON, INC. (US) | 2010-04-15 | — | — | WO | disclosed |
| EP-1968583-A2 | COMPOUNDS, SCREENS, AND METHODS OF TREATMENT | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007075772-A2 | COMPOUNDS, SCREENS, AND METHODS OF TREATMENT | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2007-07-05 | — | — | WO | disclosed |