Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 3/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | SMO | Q99835 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7003624 | 0.99 | OPRM1 (0.39) | OPRM1OPRD1OPRK1GRIN2BFYN | |
| SCHEMBL6991856 | 0.82 | PRMT5 (0.43) | PARP1MAOAMAOB | |
| Hydrochloric Acid SCHEMBL6996290 | 0.81 | PRMT5 (0.43) | PARP1MAOAMAOB | |
| SCHEMBL7091667 | 0.80 | PRMT5 (0.51) | — | |
| Hydrochloric Acid SCHEMBL6989619 | 0.79 | PRMT5 (0.50) | — | |
| Hydrochloric Acid SCHEMBL7713373 | 0.77 | PARP1 (0.53) | PARP1HTT | |
| SCHEMBL6992904 | 0.75 | PARP1 (0.66) | FYNPARP1HDAC1MAOB | |
| SCHEMBL7000588 | 0.74 | PARP1 (0.37) | PARP1 | |
| Hydrochloric Acid SCHEMBL7707646 | 0.74 | MEN1 (0.41) | PARP1CYP3A4HTT | |
| Hydrochloric Acid SCHEMBL7000763 | 0.73 | PARP1 (0.43) | PARP1HTT |
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-1015437-B1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AG (DE) | 2003-12-03 | — | — | EP | claimed |