Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN2 | Q9H2S1 | 4/20 | 0.34 |
| ▸ | KCNN3 | Q9UGI6 | 4/20 | 0.34 |
| ▸ | KCNN1 | Q92952 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 8/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 8/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 8/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 8/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 8/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 8/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 8/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13372740 | 0.89 | KCNN2 (0.34) | KCNN2KCNN3KCNN1GRIN2DGRIN3B | |
| SCHEMBL13372899 | 0.83 | MAOA (0.39) | HTTSMN1; SMN2ALDH1A1POLB | |
| SCHEMBL3307517 | 0.81 | KDM4E (0.40) | KCNN2KCNN3KCNN1HTTSMN1; SMN2 | |
| SCHEMBL3303694 | 0.79 | KDM4E (0.36) | KCNN2KCNN3KCNN1KDM4EALDH1A1 | |
| SCHEMBL4440893 | 0.77 | CYP3A4 (0.31) | SMN1; SMN2 | |
| SCHEMBL3305816 | 0.76 | KCNN2 (0.39) | KCNN2KCNN3KCNN1OPRK1KDM4E | |
| SCHEMBL4582601 | 0.71 | ALDH1A1 (0.38) | OPRM1KDM4EALDH1A1POLB | |
| SCHEMBL4431441 | 0.69 | WDR91 (0.41) | KDM4EALDH1A1 | |
| SCHEMBL4428221 | 0.69 | MAOA (0.40) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL3311778 | 0.67 | KCNN2 (0.38) | KCNN2KCNN3KCNN1KDM4EALDH1A1 |
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-2132193-B1 | SUBSTITUTED PYRROLIDINE AMIDES, THE PRODUCTION THEREOF, AND THE USE THEREOF AS MEDICATIONS | BOEHRINGER INGELHEIM INT (DE) | 2012-10-24 | — | — | EP | disclosed |
| EP-2132193-A1 | SUBSTITUTED PYRROLIDINE AMIDES, THE PRODUCTION THEREOF, AND THE USE THEREOF AS MEDICATIONS | Boehringer Ingelheim International GmbH (DE) | 2009-12-16 | — | — | EP | disclosed |
| WO-2008116881-A1 | SUBSTITUTED PYRROLIDINE AMIDES, THE PRODUCTION THEREOF, AND THE USE THEREOF AS MEDICATIONS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-10-02 | — | — | WO | disclosed |