Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | TRPC3 | Q13507 | 2/20 | 0.54 |
| ▸ | TRPC7 | Q9HCX4 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | DHFR | P00374 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7379278 | 0.89 | SMN1; SMN2 (0.56) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| SCHEMBL2881051 | 0.89 | JAK2 (0.47) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| Guanidine SCHEMBL3709856 | 0.84 | SMN1; SMN2 (0.54) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| SCHEMBL16545218 | 0.83 | SMN1; SMN2 (0.60) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| SCHEMBL7411253 | 0.83 | SMN1; SMN2 (0.60) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| SCHEMBL3706053 | 0.80 | HRH4 (0.53) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| SCHEMBL13263856 | 0.80 | TRPC3 (0.51) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| SCHEMBL3708495 | 0.79 | HRH4 (0.54) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| SCHEMBL7374322 | 0.79 | SMN1; SMN2 (0.57) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 | |
| SCHEMBL12953174 | 0.78 | TRPC3 (0.52) | SMN1; SMN2CYP2C19TRPC3TRPC7NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010094721-A1 | PIPERIDIN-PYRIMIDINE DERIVATIVES AS ANTAGONISTS OF HISTAMINE H4 RECEPTOR | PALAU PHARMA, S. A. (ES) | 2010-08-26 | — | — | WO | disclosed |