Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | TACR3 | P29371 | 1/20 | 0.48 |
| ▸ | AR | P10275 | 3/20 | 0.48 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.47 |
| ▸ | MC4R | P32245 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | RBP4 | P02753 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13698576 | 0.85 | MAPT (0.52) | MAPTTSHRCYP2C9HDAC1HDAC6 | |
| SCHEMBL5240537 | 0.76 | HTR3E (0.61) | MAPTTSHRCYP2C9HDAC1HDAC6 | |
| SCHEMBL13698487 | 0.76 | DRD2 (0.62) | MAPTTSHRHTR3EHTR3BHTR3A | |
| SCHEMBL22892259 | 0.73 | LMNA (0.59) | MAPTTSHRCYP2C9HDAC1HDAC6 | |
| SCHEMBL24376184 | 0.73 | KDM4E (0.53) | LMNAALDH1A1POLB | |
| SCHEMBL12632946 | 0.72 | CYP2C9 (0.58) | MAPTCYP2C9HDAC1HDAC6TACR3 | |
| SCHEMBL11241401 | 0.72 | ADRA1D (0.43) | TSHRLMNAKMT2AMEN1ALDH1A1 | |
| SCHEMBL3972625 | 0.70 | DRD2 (0.46) | MAPTTSHRHTR3EHTR3BHTR3A | |
| SCHEMBL3454088 | 0.70 | KDM4E (0.61) | TSHRLMNAKMT2AMEN1ALDH1A1 | |
| SCHEMBL4336114 | 0.69 | HTR3E (0.69) | CYP2C9HDAC1HDAC6HTR3EHTR3B |
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-7563795-B2 | Phenyl-piperazine derivatives as modulators of muscarinic receptors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-07-21 | — | — | US | disclosed |
| US-7563795-B2 | Phenyl-piperazine derivatives as modulators of muscarinic receptors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-07-21 | — | — | US | disclosed |