Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL772676 | 1.00 | MEN1 (0.32) | MEN1CYP3A4ALOX15KMT2ACTSK | |
| SCHEMBL454434 | 0.75 | ALOX15 (0.44) | MEN1CYP3A4ALOX15KMT2A | |
| SCHEMBL6951469 | 0.75 | CTSK (0.32) | CTSK | |
| SCHEMBL16620222 | 0.73 | CTSK (0.38) | CTSK | |
| SCHEMBL22931072 | 0.70 | — | — | |
| SCHEMBL169832 | 0.70 | — | — | |
| SCHEMBL26742123 | 0.69 | GRIK1 (0.31) | CTSK | |
| SCHEMBL15447174 | 0.67 | GRIK1 (0.39) | CTSK | |
| SCHEMBL8915277 | 0.66 | — | — | |
| SCHEMBL29404325 | 0.64 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120070879-A1 | REDUCTION OF ANTIBIOTIC ACTIVITY OR CONCENTRATION IN BIOLOGICAL SAMPLES USING MOLECULARLY IMPRINTED POLYMERS | BECTON, DICKINSON AND COMPANY (US) | 2012-03-22 | — | — | US | disclosed |