Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | MPI | P34949 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL769450 | 0.80 | MPI (0.37) | AKR1B1MPILMNAALDH1A1 | |
| SCHEMBL6028031 | 0.75 | AKR1B1 (0.37) | AKR1B1MPI | |
| SCHEMBL4167823 | 0.72 | MPI (0.43) | AKR1B1MPILMNAALDH1A1 | |
| SCHEMBL1660690 | 0.72 | MPI (0.43) | AKR1B1MPILMNAALDH1A1 | |
| SCHEMBL17984942 | 0.72 | MPI (0.43) | AKR1B1MPILMNAALDH1A1 | |
| SCHEMBL450548 | 0.72 | MPI (0.43) | AKR1B1MPILMNAALDH1A1 | |
| SCHEMBL15855477 | 0.68 | AKR1B1 (0.39) | AKR1B1MPILMNAALDH1A1 | |
| Phosphoric Acid SCHEMBL5789226 | 0.67 | MPI (0.48) | AKR1B1MPILMNAALDH1A1 | |
| SCHEMBL11408181 | 0.66 | — | — | |
| SCHEMBL1745742 | 0.66 | — | — |
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-1638549-A2 | NOVEL ANTIBACTERIAL AGENTS | Optimer Pharmaceuticals, Inc. (US) | 2006-03-29 | — | — | EP | disclosed |
| WO-2004080391-A2 | NOVEL ANTIBACTERIAL AGENTS | OPTIMER PHARMACEUTICALS, INC. (US) | 2004-09-23 | — | — | WO | disclosed |