Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 4/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15718370 | 0.83 | ALDH1A1 (0.41) | ALDH1A1KDM4EPPARAPPARDMAPT | |
| SCHEMBL17476827 | 0.81 | ALDH1A1 (0.42) | ALDH1A1KDM4EPPARAPPARDMAPT | |
| SCHEMBL3723070 | 0.81 | ALDH1A1 (0.42) | ALDH1A1KDM4EPPARAPPARDMAPT | |
| SCHEMBL1892567 | 0.79 | ALDH1A1 (0.41) | ALDH1A1KDM4EPPARAPPARDMAPT | |
| SCHEMBL2441978 | 0.79 | PPARA (0.53) | ALDH1A1PPARAPPARDMAPTMEN1 | |
| SCHEMBL3937220 | 0.78 | PPARG (0.39) | ALDH1A1PPARAMAPTMEN1KMT2A | |
| SCHEMBL6358939 | 0.78 | KDM4E (0.40) | ALDH1A1KDM4EPPARAPPARDMAPT | |
| SCHEMBL21991270 | 0.77 | PPARA (0.43) | ALDH1A1KDM4EPPARAPPARDMAPT | |
| SCHEMBL17157400 | 0.76 | MCHR1 (0.41) | ALDH1A1KDM4EPPARAPPARDMAPT | |
| SCHEMBL1006518 | 0.75 | ALDH1A1 (0.42) | ALDH1A1KDM4EPPARAPPARDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009133970-A1 | CRYSTALLINE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-11-05 | — | — | WO | disclosed |
| EP-2074117-A2 | HETEROMONOCYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008062905-A2 | HETEROMONOCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-05-29 | — | — | WO | disclosed |