Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.61 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NOS2 | P35228 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 4/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6466772 | 0.93 | UHRF1 (0.46) | UHRF1CCR1CCR5CCR8NOS1 | |
| Iodide SCHEMBL29636268 | 0.91 | UHRF1 (0.45) | UHRF1CCR1CCR5CCR8NOS1 | |
| Bromide SCHEMBL27973630 | 0.91 | UHRF1 (0.45) | UHRF1CCR1CCR5CCR8NOS1 | |
| Diethylamine SCHEMBL6638505 | 0.83 | KMT2A (0.42) | UHRF1CCR1CCR5CCR8NOS1 | |
| SCHEMBL8565055 | 0.81 | UHRF1 (0.43) | UHRF1CCR1CCR5CCR8NOS1 | |
| SCHEMBL20099912 | 0.80 | UHRF1 (0.42) | UHRF1CCR1CCR5CCR8NOS1 | |
| Bromide SCHEMBL38664578 | 0.79 | UHRF1 (0.41) | UHRF1CCR1CCR5CCR8NOS1 | |
| SCHEMBL8569721 | 0.79 | UHRF1 (0.41) | UHRF1CCR1CCR5CCR8NOS1 | |
| SCHEMBL44068 | 0.78 | — | — | |
| SCHEMBL29365333 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005024041-A2 | ALKYL-SUBSTITUTED VINYL PYRIDINES FOR MASS-CODED TAGGING OF PROTEINS | BIO-RAD LABORATORIES, INC. (US) | 2005-03-17 | — | — | WO | disclosed |