Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 5/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL27656244 | 0.75 | — | — | |
| SCHEMBL7549164 | 0.72 | CHRM2 (0.46) | CHRM2CHRM1KMT2AMEN1CYP2D6 | |
| SCHEMBL13079825 | 0.70 | CHRM2 (0.47) | CHRM2CHRM1KMT2AMEN1CYP2D6 | |
| SCHEMBL22006156 | 0.70 | CHRM2 (0.47) | CHRM2CHRM1KMT2AMEN1CYP2D6 | |
| SCHEMBL17807032 | 0.70 | CHRM2 (0.47) | CHRM2CHRM1KMT2AMEN1CYP2D6 | |
| SCHEMBL28522654 | 0.70 | CHRM2 (0.47) | CHRM2CHRM1KMT2AMEN1CYP2D6 | |
| SCHEMBL28284032 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL6429689 | 0.69 | CHRM2 (0.45) | CHRM2CHRM1KMT2AMEN1CYP2D6 | |
| SCHEMBL24928545 | 0.68 | CHRM2 (0.41) | CHRM2CHRM1KMT2AMEN1CYP2D6 | |
| SCHEMBL30202204 | 0.68 | CHRM2 (0.41) | CHRM2CHRM1KMT2AMEN1CYP2D6 |
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-2010476-A2 | C-NITROSO-DERIVED NITROXYL DONORS | Wake Forest University Health Sciences (US) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007120839-A2 | C-NITROSO-DERIVED NITROXYL DONORS | WAKE FOREST UNIVERSITY HEALTH SCIENCES (US) | 2007-10-25 | — | — | WO | disclosed |