Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | S100A4 | P26447 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 3/20 | 0.35 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7554952 | 0.79 | GAA (0.59) | BTKLRRK2SLC22A12MEN1KMT2A | |
| SCHEMBL7086950 | 0.77 | SMN1; SMN2 (0.42) | MEN1KMT2AGAAL3MBTL1ALDH1A1 | |
| SCHEMBL20057675 | 0.75 | MAPT (0.54) | KMT2AGAAL3MBTL1ALDH1A1MAPT | |
| SCHEMBL7345513 | 0.75 | MEN1 (0.49) | MEN1KMT2AL3MBTL1ALDH1A1MAPT | |
| SCHEMBL5266402 | 0.72 | SLC22A12 (0.44) | BTKLRRK2SLC22A12ATRAPLNR | |
| SCHEMBL14797051 | 0.72 | ADRA1D (0.41) | BTKATRMEN1KMT2AL3MBTL1 | |
| SCHEMBL31263996 | 0.71 | AURKA (0.46) | LRRK2SLC22A12MEN1KMT2AGAA | |
| Hydrochloric Acid SCHEMBL21598400 | 0.71 | SLC22A12 (0.43) | BTKLRRK2SLC22A12ATRAPLNR | |
| SCHEMBL14676415 | 0.71 | PLAU (0.48) | — | |
| SCHEMBL3904232 | 0.70 | SLC22A12 (0.46) | BTKSLC22A12ATRTYK2APLNR |
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-6495576-B2 | N-(1-((3,4-DIOXO-2-(3-PYRIDINYLAMINO)-1-CYCLOBUTEN-1-YL)AMINO) -2,2-DIMETHYLPROPYL)-4-METHYLBENZAMIDE FOR EXAMPLE; TREATING BLADDER OVERACTIVITY, BENIGN PROSTATIC HYPERPLASIA, PREMATURE LABOR, AND SEXUAL DISORDERS | ABBOTT LABORATORIES | 2002-12-17 | — | — | US | disclosed |