Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5745558 | 1.00 | MEN1 (0.45) | MEN1KMT2ATP53MAPTHTT | |
| SCHEMBL5745560 | 0.78 | ADRA1B (0.36) | MEN1KMT2ATP53MAPTHTT | |
| SCHEMBL5748375 | 0.74 | DRD2 (0.49) | MAPTLMNAADRA1BDRD2HTR1A | |
| SCHEMBL5748386 | 0.74 | DRD2 (0.49) | MAPTLMNAADRA1BDRD2HTR1A | |
| SCHEMBL5748586 | 0.73 | HTR3E (0.41) | MAPTLMNAADRA1BADRA1ADRD2 | |
| SCHEMBL7713575 | 0.70 | MEN1 (0.64) | MEN1KMT2ATP53MAPTLMNA | |
| SCHEMBL12879728 | 0.69 | DRD2 (0.62) | MEN1KMT2AADRA1BADRA1ADRD2 | |
| Hydrochloric Acid SCHEMBL7711550 | 0.69 | MEN1 (0.66) | MEN1KMT2ATP53MAPTLMNA | |
| SCHEMBL16440197 | 0.69 | MEN1 (0.55) | MEN1KMT2ATP53MAPTHTT | |
| SCHEMBL5267087 | 0.69 | DRD2 (0.59) | MEN1KMT2AADRA1BADRA1ADRD2 |
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-1673089-A2 | PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS | Vertex Pharmaceuticals Incorporated (US) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005030188-A2 | PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-04-07 | — | — | WO | disclosed |