Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MPI | P34949 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 3/20 | 0.43 |
| ▸ | SLC6A15 | Q9H2J7 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4010098 | 0.85 | MAPT (0.49) | HTR2AHTR2CSLC6A4MAPTALDH1A1 | |
| SCHEMBL3917828 | 0.84 | MAPT (0.43) | HTR2AMAPTALDH1A1GAASMN1; SMN2 | |
| SCHEMBL1048457 | 0.81 | POLB (0.55) | HTR2AHTR2CSLC6A4MAPTKDM4E | |
| SCHEMBL5698823 | 0.81 | SMN1; SMN2 (0.41) | MAPTALDH1A1GAASMN1; SMN2LMNA | |
| SCHEMBL3919075 | 0.79 | HRH1 (0.42) | MAPTALDH1A1GAASMN1; SMN2KDM4E | |
| SCHEMBL3916322 | 0.79 | HRH1 (0.45) | HTR2AMAPTALDH1A1GAASMN1; SMN2 | |
| SCHEMBL4800403 | 0.79 | CYP1A2 (0.42) | MAPTALDH1A1SMN1; SMN2LMNAHRH1 | |
| SCHEMBL3917775 | 0.79 | SMN1; SMN2 (0.47) | HTR2AMAPTALDH1A1GAASMN1; SMN2 | |
| SCHEMBL5757481 | 0.78 | LMNA (0.47) | HTR2AMAPTALDH1A1GAASMN1; SMN2 | |
| SCHEMBL5698822 | 0.78 | IDE (0.40) | HTR2AMAPTALDH1A1GAASMN1; SMN2 |
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-1567511-A1 | SUBSTITUTED PIPERAZINES, (1,4) DIASZEPINES, AND 2,5-DIAZABICYCLO (2.2.1) HEPTANES AS HISTAMINE H1 AND/OR H3 ANTAGONISTS OR HISTAMINE H3 REVERSE ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004035556-A1 | SUBSTITUTED PIPERAZINES, (1,4) DIASZEPINES, AND 2,5-DIAZABICYCLO (2.2.1) HEPTANES AS HISTAMINE H1 AND/OR H3 ANTAGONISTS OR HISTAMINE H3 REVERSE ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2004-04-29 | — | — | WO | disclosed |