Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | HRH2 | P25021 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.42 |
| ▸ | TPSAB1 | Q15661 | 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 | |
|---|---|---|---|---|
| SCHEMBL5205011 | 0.90 | HTR2A (0.42) | ALDH1A1SMN1; SMN2HTTHRH2CNR2 | |
| SCHEMBL5205803 | 0.82 | HRH2 (0.50) | HRH2CNR2HTR2AHTR2CHTR2B | |
| SCHEMBL5204952 | 0.78 | HRH2 (0.55) | ALDH1A1HRH2CNR2HTR2AHTR2C | |
| SCHEMBL4859740 | 0.75 | HTR2A (0.46) | HRH2CNR2HTR2AHTR2CHTR2B | |
| SCHEMBL5203872 | 0.74 | TPSAB1 (0.48) | ALDH1A1SMN1; SMN2HRH2CNR2HTR2A | |
| SCHEMBL4862667 | 0.74 | TSHR (0.47) | ALDH1A1SMN1; SMN2HRH2CNR2KMT2A | |
| SCHEMBL5203433 | 0.73 | TPSAB1 (0.50) | HRH2CNR2HTR2AHTR2CHTR2B | |
| SCHEMBL5203757 | 0.73 | NPC1 (0.57) | ALDH1A1SMN1; SMN2HRH2L3MBTL1MEN1 | |
| SCHEMBL5201910 | 0.72 | NPC1 (0.42) | HTTHRH2CNR2LMNAMEN1 | |
| SCHEMBL4849757 | 0.72 | HRH2 (0.47) | ALDH1A1SMN1; SMN2HRH2CNR2L3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2007501828-A | — | — | 2007-02-01 | — | — | JP | claimed |
| EP-1654253-B1 | SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2007-01-03 | — | — | EP | claimed |
| EP-1654253-A1 | SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES | Grünenthal GmbH (DE) | 2006-05-10 | — | — | EP | claimed |
| WO-2005019208-A1 | SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES | Grünenthal GmbH (DE) | 2005-03-03 | — | — | WO | claimed |