Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CCNC | P24863 | 2/20 | 0.37 |
| ▸ | CDK8 | P49336 | 2/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.36 |
| ▸ | MC4R | P32245 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL197434 | 0.87 | HTR2C (0.47) | HTR2CHTR2ABRD4KDM4ECASP1 | |
| Hydrochloric Acid SCHEMBL7172386 | 0.85 | HTR2C (0.46) | HTR2CHTR2ABRD4KDM4ECASP1 | |
| Hydrochloric Acid SCHEMBL7179318 | 0.85 | HTR2C (0.46) | HTR2CHTR2ABRD4KDM4ECASP1 | |
| Hydrochloric Acid SCHEMBL7175653 | 0.85 | HTR2C (0.46) | HTR2CHTR2ABRD4KDM4ECASP1 | |
| Hydrochloric Acid SCHEMBL7173179 | 0.85 | HTR2C (0.46) | HTR2CHTR2ABRD4KDM4ECASP1 | |
| Hydrochloric Acid SCHEMBL7171164 | 0.85 | HTR2C (0.46) | HTR2CHTR2ABRD4KDM4ECASP1 | |
| Hydrochloric Acid SCHEMBL7176249 | 0.85 | HTR2C (0.46) | HTR2CHTR2ABRD4KDM4ECASP1 | |
| SCHEMBL4109690 | 0.82 | CCR1 (0.54) | HTR2CHTR2ABRD4KDM4ECASP1 | |
| SCHEMBL18027911 | 0.80 | IDH1 (0.38) | MC4RNR1H4IDH1IDH2 | |
| SCHEMBL12877216 | 0.79 | HTR2C (0.42) | HTR2CHTR2ABRD4KDM4ECASP1 |
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-1828146-B1 | SUBSTITUTED N-HETEROCYCLIC COMPOUNDS AND THEIR USE AS DOPAMINE D3 RECEPTOR LIGANDS | ABBVIE DEUTSCHLAND (DE) | 2014-11-05 | — | — | EP | disclosed |
| EP-1828146-A1 | SUBSTITUTED N-HETEROCYCLIC COMPOUNDS AND THEIR USE AS DOPAMINE D3 RECEPTOR LIGANDS | Abbott GmbH & Co. KG (DE) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006066885-A1 | SUBSTITUTED N-HETEROCYCLIC COMPOUNDS AND THEIR USE AS DOPAMINE D3 RECEPTOR LIGANDS | ABBOTT GMBH & CO. KG (DE) | 2006-06-29 | — | — | WO | disclosed |