Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.58 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | NSD2 | O96028 | 1/20 | 0.47 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7278715 | 0.84 | OPRD1 (0.50) | CYP2D6CYP19A1OPRD1OPRM1ADRB1 | |
| SCHEMBL793646 | 0.84 | OPRD1 (0.60) | OPRD1OPRM1SLC6A2SLC6A4 | |
| SCHEMBL7282376 | 0.82 | SLC6A4 (0.49) | CYP2D6CYP19A1OPRD1HTR3EHTR3B | |
| SCHEMBL15797474 | 0.81 | SMN1; SMN2 (0.59) | NSD2ADRB2SMN1; SMN2ALDH1A1 | |
| SCHEMBL25083517 | 0.81 | CYP2D6 (0.54) | CYP2D6CYP19A1OPRD1OPRM1CHEK2 | |
| SCHEMBL7282015 | 0.81 | TEAD1 (0.53) | OPRD1SLC6A4 | |
| SCHEMBL7288846 | 0.81 | CHRM2 (0.55) | CYP2D6OPRD1OPRM1HTR3EHTR3B | |
| SCHEMBL7279116 | 0.81 | OPRD1 (0.44) | CYP2D6CYP19A1OPRD1OPRM1SLC6A4 | |
| Hydrochloric Acid SCHEMBL29894729 | 0.80 | CYP2D6 (0.53) | CYP2D6CYP19A1OPRD1OPRM1HTR3E | |
| SCHEMBL7289405 | 0.80 | CHRM2 (0.49) | CYP2D6CYP19A1OPRD1OPRM1SLC6A2 |
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-4567264-A | ADRENERGIC BLOCKING AGENTS | SYNTEX (U.S.A.) INC. (US) | 1986-01-28 | — | — | US | disclosed |
| EP-0126449-A1 | Cardioselective aryloxy- and arylthio-hydroxypropyl piperazinyl acetanilides wich affect calcium entry | SYNTEX (U.S.A.) INC. (US) | 1984-11-28 | — | — | EP | disclosed |