Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | PPARD | Q03181 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 3/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.40 |
| ▸ | HTR1D | P28221 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1378534 | 0.93 | PPARD (0.41) | KDM4EPPARGPPARDPPARATSHR | |
| SCHEMBL5176799 | 0.88 | PKM (0.44) | KDM4EPPARGPPARDPPARAMTNR1A | |
| SCHEMBL1378359 | 0.83 | PPARD (0.43) | KDM4EPPARGPPARDPPARATSHR | |
| SCHEMBL5176537 | 0.81 | KDM4E (0.42) | KDM4EPPARGPPARDPPARATRPV1 | |
| SCHEMBL5177101 | 0.81 | PPARD (0.36) | KDM4EPPARGPPARDPPARATRPV1 | |
| SCHEMBL6510001 | 0.81 | KDM4E (0.69) | KDM4EPPARGPPARDPPARATSHR | |
| SCHEMBL5177050 | 0.81 | PKM (0.44) | PPARGPPARDPPARATRPV1ALDH1A1 | |
| SCHEMBL1380488 | 0.81 | GOT1 (0.43) | KDM4ETSHRMTNR1AMTNR1BTRPV1 | |
| SCHEMBL1377425 | 0.77 | PPARD (0.42) | PPARGPPARDPPARAMTNR1AMTNR1B | |
| SCHEMBL1383911 | 0.77 | KDM4E (0.41) | KDM4EPPARGPPARDPPARATSHR |
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-4629106-B2 | — | — | 2011-02-09 | — | — | JP | claimed |
| JP-2008509947-A | — | — | 2008-04-03 | — | — | JP | claimed |
| EP-1781608-A1 | INDOLE DERIVATIVES COMPRISING AN ACETYLENE GROUP AS PPAR ACTIVATORS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-05-09 | — | — | EP | claimed |
| WO-2006018174-A1 | INDOLE DERIVATIVES COMPRISING AN ACETYLENE GROUP AS PPAR ACTIVATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-02-23 | — | — | WO | claimed |