Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PRF1 | P14222 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | STK10 | O94804 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.31 |
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 SCHEMBL8006771 | 0.99 | OPRD1 (0.35) | OPRD1PTGS2PIK3CAHSD17B1HSD17B2 | |
| SCHEMBL7610280 | 0.82 | PTGS2 (0.37) | PTGS2HSD17B1HSD17B2MAPT | |
| Hydrochloric Acid SCHEMBL8018678 | 0.81 | ALDH1A1 (0.38) | PTGS2PIK3CAHSD17B1HSD17B2MAPT | |
| SCHEMBL7610149 | 0.81 | CTNNB1 (0.33) | OPRD1PTGS2PIK3CAHSD17B1HSD17B2 | |
| Hydrochloric Acid SCHEMBL8018169 | 0.80 | PTGS2 (0.33) | OPRD1PTGS2PIK3CAHSD17B1HSD17B2 | |
| SCHEMBL7611830 | 0.76 | OPRD1 (0.35) | OPRD1PTGS2PIK3CAHSD17B1HSD17B2 | |
| Hydrochloric Acid SCHEMBL8019741 | 0.75 | OPRD1 (0.34) | OPRD1PTGS2PIK3CAHSD17B1HSD17B2 | |
| SCHEMBL7611357 | 0.74 | HTR7 (0.42) | OPRD1HSD17B1HSD17B2MAPT | |
| SCHEMBL7605210 | 0.74 | ESR1 (0.44) | PIK3CA | |
| Hydrochloric Acid SCHEMBL8026792 | 0.73 | HTR7 (0.41) | OPRD1HSD17B1HSD17B2MAPT |
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-0922703-B1 | Substituted heterocyclic benzocycloalkenes and their use as analgesically active compounds | GRUENENTHAL GMBH (DE) | 2002-12-04 | — | — | EP | disclosed |
| EP-0922703-A1 | Substituted heterocyclic benzocycloalkenes and their use as analgesically active compounds | Grünenthal GmbH (DE) | 1999-06-16 | — | — | EP | disclosed |