Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 13/20 | 1.00 |
| ▸ | DRD2 | P14416 | 11/20 | 1.00 |
| ▸ | HTR2A | P28223 | 5/20 | 1.00 |
| ▸ | HTT | P42858 | 2/20 | 1.00 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.77 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.77 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.73 |
| ▸ | LMNA | P02545 | 3/20 | 0.73 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.73 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | HTR6 | P50406 | 1/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | TDO2 | P48775 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL13944353 | 0.89 | DRD2 (0.79) | HTR1ADRD2HTR2AHTTOPRM1 | |
| SCHEMBL11329993 | 0.88 | HTR1A (0.78) | HTR1ADRD2HTR2AHTTOPRM1 | |
| Hydrochloric Acid SCHEMBL11318644 | 0.88 | HTR1A (0.78) | HTR1ADRD2HTR2AHTTOPRM1 | |
| SCHEMBL14280720 | 0.87 | OPRM1 (1.00) | HTR1ADRD2HTR2AHTTOPRM1 | |
| SCHEMBL1719798 | 0.86 | DRD2 (0.76) | HTR1ADRD2HTR2AHTTOPRM1 | |
| SCHEMBL7536094 | 0.86 | OPRM1 (0.78) | HTR1ADRD2HTR2AHTTOPRM1 | |
| SCHEMBL9527241 | 0.86 | OPRM1 (0.78) | HTR1ADRD2HTR2AHTTOPRM1 | |
| SCHEMBL11321052 | 0.84 | KDM4E (1.00) | HTR1ADRD2HTR2AHTTOPRM1 | |
| Hydrochloric Acid SCHEMBL11325899 | 0.84 | KDM4E (1.00) | HTR1ADRD2HTR2AHTTOPRM1 | |
| SCHEMBL4469442 | 0.84 | KDM4E (0.76) | HTR1ADRD2HTR2AHTTOPRM1 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1037635-A4 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORP (US) | 2002-11-13 | — | — | EP | claimed |
| US-6476028-B1 | Compounds and methods | SMITHKLINE BEECHAM CORPORATION | 2002-11-05 | — | — | US | claimed |
| EP-1037635-A1 | COMPOUNDS AND METHODS | Smithkline Beecham (US) | 2000-09-27 | — | — | EP | claimed |
| WO-1999017773-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-04-15 | — | — | WO | claimed |
| CN-102796075-B | Benzocycloheptenes derivative as well as preparation method and medical application thereof | INST PHARM & TOXICOLOGY AMMS | 2014-03-12 | — | — | CN | disclosed |
| CN-101481323-B | Benzocycloheptenes derivatives, preparation method and medical application thereof | POISON MED INST PLA MED ACAD | 2013-11-20 | — | — | CN | disclosed |
| CN-102796075-A | Benzocycloheptenes derivative as well as preparation method and medical application thereof | INST PHARM & TOXICOLOGY AMMS | 2012-11-28 | — | — | CN | disclosed |
| CN-101481323-A | Benzocycloheptenes derivatives, preparation method and medical application thereof | POISON MED INST PLA MED ACAD (CN) | 2009-07-15 | — | — | CN | disclosed |
| EP-1037635-A4 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORP (US) | 2002-11-13 | — | — | EP | disclosed |
| US-6476028-B1 | Compounds and methods | SMITHKLINE BEECHAM CORPORATION | 2002-11-05 | — | — | US | disclosed |
| EP-1037635-A1 | COMPOUNDS AND METHODS | Smithkline Beecham (US) | 2000-09-27 | — | — | EP | disclosed |
| WO-1999017773-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-04-15 | — | — | WO | disclosed |
| US-3947578-A | Omega-[4-(3\"-indolyl)-piperidino]-alkyl-arylketones as nevroleptics | ROUSSEL UCLAF (FR) | 1976-03-30 | — | — | US | disclosed |