Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.60 |
| ▸ | DRD2 | P14416 | 5/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.58 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.56 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.56 |
| ▸ | HTR7 | P34969 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | GMNN | O75496 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5984495 | 0.82 | CYP2D6 (0.85) | CYP2D6CYP2C9CHRM1DRD2KCNH2 | |
| SCHEMBL9872838 | 0.80 | HTR7 (0.54) | DRD2KCNH2ADRA1AADRA1BHTR7 | |
| SCHEMBL6404859 | 0.78 | CHRM1 (0.88) | CYP2D6CYP2C9CHRM1DRD2KCNH2 | |
| SCHEMBL5772590 | 0.78 | CYP2D6 (1.00) | CYP2D6CYP2C9CHRM1DRD2KCNH2 | |
| SCHEMBL9757165 | 0.77 | HTR7 (0.66) | DRD2KCNH2ADRA1AADRA1BHTR7 | |
| SCHEMBL6404540 | 0.77 | PLD1 (0.81) | CYP2D6CYP2C9CHRM1DRD2KCNH2 | |
| SCHEMBL11878362 | 0.77 | ADRA1A (0.84) | CYP2D6CYP2C9CHRM1DRD2KCNH2 | |
| SCHEMBL9757338 | 0.77 | ADRA1D (0.60) | ADRA1D | |
| SCHEMBL11507088 | 0.77 | DRD2 (0.82) | CYP2D6CYP2C9CHRM1DRD2KCNH2 | |
| Hydrochloric Acid SCHEMBL7256214 | 0.77 | CYP2D6 (0.76) | CYP2D6CYP2C9CHRM1DRD2KCNH2 |
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-5036075-A | Serotonin antagonists | RHONE-POULENC SANTE (FR) | 1991-07-30 | — | — | US | disclosed |
| US-5021420-A | Antiserotonine agents; central nervous system, gastroin-testinal and cardiovascular disorders | RHONE-POULENC SANTE (FR) | 1991-06-04 | — | — | US | disclosed |