Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | USP2 | O75604 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL4116754 | 0.71 | ACE (0.35) | NOTUMTSHRP2RY1CYP1A2CYP3A4 | |
| SCHEMBL3994423 | 0.70 | DPP9 (0.35) | NOTUMTSHRKMT2AP2RY1CYP1A2 | |
| Hydrochloric Acid SCHEMBL1747690 | 0.70 | NOTUM (0.34) | SMN1; SMN2GAANOTUMTSHRALDH1A1 | |
| SCHEMBL2172112 | 0.70 | GAA (0.36) | SMN1; SMN2GAANOTUMKMT2ACYP1A2 | |
| SCHEMBL655024 | 0.67 | NOTUM (0.80) | SMN1; SMN2GAANOTUMALDH1A1HDAC1 | |
| Hydrochloric Acid SCHEMBL2257588 | 0.66 | NOTUM (0.78) | SMN1; SMN2GAANOTUMALDH1A1HDAC1 | |
| SCHEMBL7568469 | 0.65 | NOTUM (0.50) | NOTUMALDH1A1HDAC1HDAC6P2RY1 | |
| SCHEMBL240532 | 0.65 | MCHR2 (0.44) | SMN1; SMN2GAAALOX15KCNH2SIGMAR1 | |
| SCHEMBL240533 | 0.65 | MCHR2 (0.44) | SMN1; SMN2GAAALOX15KCNH2SIGMAR1 | |
| SCHEMBL5599270 | 0.65 | NOTUM (0.33) | NOTUMROCK2ROCK1OPRM1 |
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-1817036-A2 | MODULATORS OF MUSCARINIC RECEPTORS | Vertex Pharmaceuticals Incorporated (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006058303-A2 | MODULATORS OF MUSCARINIC RECEPTORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-06-01 | — | — | WO | disclosed |