Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 5/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.42 |
| ▸ | DRD2 | P14416 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | HTR2B | P41595 | 3/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.40 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9471706 | 0.89 | SIGMAR1 (0.40) | CCR5SIGMAR1DRD2HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL9471306 | 0.88 | SIGMAR1 (0.39) | CCR5SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL7331583 | 0.88 | LSS (0.44) | CCR5SIGMAR1DRD2HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL9470905 | 0.88 | ALDH1A1 (0.43) | SIGMAR1DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL7328690 | 0.87 | CCR5 (0.46) | CCR5SIGMAR1OPRM1CHRM2CHRM3 | |
| Hydrochloric Acid SCHEMBL9471582 | 0.87 | MCHR1 (0.39) | CCR5SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL7270725 | 0.87 | SIGMAR1 (0.47) | CCR5SIGMAR1DRD2HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL9471285 | 0.87 | LSS (0.43) | CCR5SIGMAR1DRD2HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL9471914 | 0.87 | KCNH2 (0.40) | CCR5SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL7339644 | 0.87 | SIGMAR1 (0.40) | CCR5SIGMAR1DRD2HTR2AHTR2C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0457686-B1 | Novel aminopiperidine, aminopyrrolidine and aminoperhydroazepine derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 1994-08-03 | — | — | EP | claimed |
| US-5189045-A | Antiserotonine agent | ADIR ET COMPAGNIE (FR) | 1993-02-23 | — | — | US | claimed |
| US-5189045-A | Antiserotonine agent | ADIR ET COMPAGNIE (FR) | 1993-02-23 | — | — | US | disclosed |