Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 5/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR1E | P28566 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
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 SCHEMBL8018161 | 0.99 | HTR7 (0.44) | HTR7OPRD1ABCB1KDM1AMAOA | |
| SCHEMBL7591721 | 0.86 | SLC6A4 (0.41) | HTR7OPRD1ADRA2AADRA2BADRA2C | |
| SCHEMBL7586084 | 0.86 | HTR7 (0.50) | HTR7HTR1AHTR1DHTR1BHTR2A | |
| Hydrochloric Acid SCHEMBL8011602 | 0.85 | SLC6A4 (0.40) | HTR7OPRD1ADRA2AADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL8002527 | 0.85 | HTR7 (0.49) | HTR7HTR1AHTR1DHTR1BHTR2A | |
| SCHEMBL7588577 | 0.85 | HSD17B1 (0.35) | ADRA2AADRA2BADRA2CHSD17B2HSD17B1 | |
| SCHEMBL7590974 | 0.84 | HSD17B1 (0.36) | HTR7OPRD1ADRA2AADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL8014383 | 0.84 | HSD17B1 (0.34) | ADRA2AADRA2BADRA2CHSD17B2HSD17B1 | |
| Hydrochloric Acid SCHEMBL8011897 | 0.83 | OPRK1 (0.35) | HTR7OPRD1ADRA2AADRA2BADRA2C | |
| SCHEMBL7611357 | 0.82 | HTR7 (0.42) | HTR7OPRD1ABCB1KDM1AMAOA |
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-0864559-B1 | Substituted amino compounds and their use as analgesic active substances | GRUENENTHAL GMBH (DE) | 2002-06-05 | — | — | EP | disclosed |
| EP-0864559-A1 | Substituted amino compounds and their use as analgesic active substances | Grünenthal GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |