Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 5/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP4 | P49662 | 1/20 | 0.41 |
| ▸ | CASP5 | P51878 | 1/20 | 0.41 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 SCHEMBL4858550 | 0.99 | OPRL1 (0.42) | OPRL1OPRM1OPRK1HTR1AADRA1B | |
| Hydrochloric Acid SCHEMBL4858269 | 0.95 | HTR1A (0.41) | OPRL1OPRM1OPRK1HTR1AADRA1B | |
| SCHEMBL1448996 | 0.94 | HTR1A (0.41) | HTR1AADRA1B | |
| Hydrochloric Acid SCHEMBL1448989 | 0.93 | HTR1A (0.40) | HTR1AADRA1B | |
| Bromide SCHEMBL1448552 | 0.93 | HTR1A (0.40) | HTR1AADRA1B | |
| Hydrochloric Acid SCHEMBL1449007 | 0.93 | HTR1A (0.40) | HTR1AADRA1B | |
| Sulfuric Acid SCHEMBL1448555 | 0.87 | PARP1 (0.41) | OPRL1HTR1AADRA1B | |
| Hydrochloric Acid SCHEMBL4857040 | 0.87 | HTR1A (0.37) | HTR1AADRA1BSIGMAR1 | |
| SCHEMBL1449825 | 0.86 | PARP1 (0.45) | OPRL1HTR1AADRA1B | |
| SCHEMBL1449300 | 0.85 | PARP1 (0.40) | OPRL1HTR1AADRA1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1698620-B1 | BENZENE COMPOUNDS DISUBSTITUTED WITH CYCLIC GROUPS AT THE 1- AND 2-POSITIONS | EISAI R&D MAN CO LTD (JP) | 2016-09-28 | — | — | EP | disclosed |
| EP-1698620-A1 | BENZENE COMPOUNDS DISUBSTITUTED WITH CYCLIC GROUPS AT THE 1- AND 2-POSITIONS | Eisai Co., Ltd. (JP) | 2006-09-06 | — | — | EP | disclosed |