Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.52 |
| ▸ | HRH1 | P35367 | 4/20 | 0.52 |
| ▸ | DRD3 | P35462 | 4/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.52 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.52 |
| ▸ | DRD2 | P14416 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | MLNR | O43193 | 1/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9600779 | 0.90 | DRD3 (0.49) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| Hydrochloric Acid SCHEMBL9602476 | 0.83 | DRD3 (0.51) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| Hydrochloric Acid SCHEMBL9601471 | 0.79 | SIGMAR1 (0.48) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| Hydrochloric Acid SCHEMBL9601482 | 0.79 | SIGMAR1 (0.48) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| Oxalic Acid SCHEMBL9602525 | 0.78 | DRD3 (0.58) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| SCHEMBL9601090 | 0.75 | CYP3A4 (0.48) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| SCHEMBL7794415 | 0.75 | DRD3 (0.53) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| Hydrochloric Acid SCHEMBL9602632 | 0.74 | MEN1 (0.49) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| Hydrochloric Acid SCHEMBL11104288 | 0.74 | MEN1 (0.69) | HTR2AADRA1AHRH1DRD3OPRK1 | |
| SCHEMBL21354137 | 0.74 | KCNH2 (0.57) | HTR2AADRA1AHRH1DRD3OPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0308476-B1 | BISPHENYLALKYLPIPERAZINE DERIVATIVES, A METHOD OF THEIR PREPARATION AND A PHARMACEUTICAL PREPARATION | Kabi Pharmacia AB (SE) | 1993-02-03 | — | — | EP | disclosed |