Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | CDC7 | O00311 | 5/20 | 0.32 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.32 |
| ▸ | CDK2 | P24941 | 5/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.32 |
| ▸ | DBF4 | Q9UBU7 | 5/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4641452 | 0.96 | SCN10A (0.35) | CHRNB2CHRNA7CHRNA4HCRTR1HCRTR2 | |
| SCHEMBL5200864 | 0.73 | ADORA2A (0.33) | — | |
| SCHEMBL5199693 | 0.71 | MAPT (0.34) | MEN1KMT2AHCRTR1HCRTR2 | |
| SCHEMBL5204446 | 0.70 | HCRTR1 (0.37) | MEN1KMT2AHCRTR1HCRTR2 | |
| SCHEMBL5200371 | 0.69 | NOS1 (0.36) | HCRTR1 | |
| SCHEMBL5199466 | 0.68 | LMNA (0.46) | MEN1KMT2ASMN1; SMN2ADRA2ANISCH | |
| SCHEMBL6173530 | 0.67 | CHRNB2 (0.45) | MEN1CYP2D6CYP2C19KMT2APOLB | |
| SCHEMBL3562054 | 0.67 | NOS2 (0.41) | MEN1CYP2D6CYP2C19KMT2APOLB | |
| SCHEMBL3346462 | 0.65 | MEN1 (0.37) | MEN1CYP2D6CYP2C19KMT2APOLB | |
| SCHEMBL9026316 | 0.63 | NISCH (0.50) | MEN1CYP2D6CYP2C19KMT2ASMN1; SMN2 |
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-1817030-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | Kalypsys, Inc. (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006060424-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | KALYPSYS, INC. (US) | 2006-06-08 | — | — | WO | disclosed |