Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 6/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.39 |
| ▸ | BCL2 | P10415 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4604053 | 0.88 | MTNR1A (0.46) | MTNR1AMTNR1BHTR2CMAOAMAOB | |
| SCHEMBL8463092 | 0.85 | HTR2C (0.57) | MTNR1AMTNR1BHTR2CHDAC8HDAC6 | |
| SCHEMBL2950735 | 0.82 | HTR2C (0.44) | MTNR1AMTNR1BHTR2CMAOAMAOB | |
| SCHEMBL2951066 | 0.81 | MCL1 (0.59) | MCL1BCL2MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL2947992 | 0.81 | KDM4E (0.46) | MTNR1AMTNR1BHDAC8HDAC6HDAC3 | |
| SCHEMBL27718498 | 0.76 | PLG (0.48) | HDAC8HDAC6HDAC11MCL1BCL2 | |
| SCHEMBL4617643 | 0.75 | PLG (0.39) | MTNR1AMTNR1BHTR2C | |
| SCHEMBL4640487 | 0.74 | KMT2A (0.41) | MAOBMEN1ALDH1A1RAB9AKMT2A | |
| SCHEMBL2949514 | 0.73 | PLAU (0.45) | MTNR1AMTNR1BHDAC8HDAC6HDAC11 | |
| SCHEMBL2950619 | 0.73 | SMN1; SMN2 (0.57) | MTNR1AMTNR1BHDAC8HDAC6HDAC3 |
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-1943220-A2 | NOVEL INDOLE-CONTAINING BETA AGONISTS, METHOD FOR PRODUCING THEM AND THEIR USE AS DRUGS | Boehringer Ingelheim International GmbH (DE) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007048841-A2 | NOVEL INDOLE-CONTAINING BETA AGONISTS, METHOD FOR PRODUCING THEM AND THEIR USE AS DRUGS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-05-03 | — | — | WO | disclosed |