Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 3/20 | 0.32 |
| ▸ | HTR2B | P41595 | 3/20 | 0.32 |
| ▸ | HTR7 | P34969 | 2/20 | 0.32 |
| ▸ | HTR5A | P47898 | 2/20 | 0.32 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | HTR3A | P46098 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8964088 | 0.94 | OPRD1 (0.37) | CHEK2CYP2D6CYP19A1OPRM1OPRD1 | |
| SCHEMBL8963650 | 0.91 | CHEK2 (0.40) | CHEK2CYP2D6CYP19A1OPRD1NPY5R | |
| SCHEMBL8963979 | 0.91 | CYP2D6 (0.42) | CHEK2CYP2D6CYP19A1OPRM1OPRD1 | |
| SCHEMBL8963637 | 0.89 | MAPK13 (0.37) | CHEK2CYP2D6OPRM1OPRD1MGAM | |
| SCHEMBL8963580 | 0.89 | PRMT5 (0.40) | OPRD1PRMT5 | |
| Hydrochloric Acid SCHEMBL8963783 | 0.88 | PRMT5 (0.40) | OPRD1PRMT5 | |
| SCHEMBL8964138 | 0.88 | SLC6A4 (0.38) | CHEK2CYP2D6OPRM1OPRD1CTSS | |
| SCHEMBL8963820 | 0.87 | HDAC6 (0.34) | CHEK2OPRM1OPRD1 | |
| SCHEMBL8963737 | 0.87 | OPRM1 (0.38) | OPRM1OPRD1GAAHTR1AHTR2B | |
| SCHEMBL8963675 | 0.84 | TACR1 (0.36) | CHEK2OPRM1OPRD1HTR1AHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| US-5514800-A | CALCIUM CHANNEL BLOCKERS, CEREBRAL ISCHEMIA | SYNTEX PHARMACEUTICALS, LTD. (GB) | 1996-05-07 | — | — | US | disclosed |