Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8552001 | 0.78 | PTGS1 (0.38) | THRBSLC6A3KMT2A | |
| SCHEMBL8546566 | 0.73 | — | — | |
| SCHEMBL6979530 | 0.72 | SLC6A3 (0.39) | THRBPOLBSLC6A3BACE1 | |
| SCHEMBL6922612 | 0.70 | CTSD (0.40) | IRAK4BACE1KMT2A | |
| SCHEMBL10755802 | 0.70 | THRB (0.36) | THRBPOLBIRAK4 | |
| SCHEMBL7620373 | 0.68 | NOS1 (0.41) | BACE1 | |
| SCHEMBL6969305 | 0.68 | ALDH1A1 (0.30) | — | |
| SCHEMBL6975876 | 0.67 | SLC6A3 (0.46) | SLC6A3 | |
| SCHEMBL6798960 | 0.66 | NOS3 (0.45) | — | |
| SCHEMBL9739310 | 0.66 | CYP2D6 (0.45) | POLBMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6011028-A | Cyclic amidino agents useful as nitric oxide synthase inhibitors | G.D. SEARLE & CO. (US) | 2000-01-04 | — | — | US | disclosed |
| EP-0821674-A1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 1998-02-04 | — | — | EP | disclosed |