Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL12475422 | 0.82 | CTSS (0.42) | — | |
| SCHEMBL14994052 | 0.74 | CYP2D6 (0.34) | CYP2D6CYP2C19 | |
| SCHEMBL26688828 | 0.71 | CYP2D6 (0.32) | CYP2D6CYP2C19 | |
| SCHEMBL9065626 | 0.71 | — | — | |
| SCHEMBL28383155 | 0.69 | — | — | |
| SCHEMBL2346017 | 0.68 | CYP2D6 (0.39) | CYP2D6CYP2C19 | |
| SCHEMBL5273019 | 0.67 | — | — | |
| SCHEMBL4390891 | 0.67 | MCL1 (0.33) | CYP2D6CYP2C19 | |
| SCHEMBL11820445 | 0.64 | ALDH1A1 (0.36) | CYP2D6CYP2C19 | |
| SCHEMBL15994867 | 0.64 | CYP2D6 (0.33) | CYP2D6CYP2C19 |
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-2673281-A1 | BORON CONTAINING POLYBASIC BACTERIAL EFFLUX PUMP INHIBITORS AND THERAPEUTICS USES THEREOF | Rempex Pharmaceuticals, Inc. (US) | 2013-12-18 | — | — | EP | disclosed |
| WO-2012109164-A1 | BORON CONTAINING POLYBASIC BACTERIAL EFFLUX PUMP INHIBITORS AND THERAPEUTICS USES THEREOF | REMPEX PHARMACEUTICALS, INC. (US) | 2012-08-16 | — | — | WO | disclosed |