Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 5/20 | 0.49 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HPSE | Q9Y251 | 4/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | FASN | P49327 | 1/20 | 0.40 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.40 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14242825 | 0.87 | CETP (0.47) | S1PR1S1PR3SMN1; SMN2 | |
| SCHEMBL17965196 | 0.86 | S1PR1 (0.45) | S1PR1S1PR3HDAC6HDAC3HDAC1 | |
| SCHEMBL17965101 | 0.83 | HTR2B (0.48) | MAPK1NPC1RAB9ASMN1; SMN2THRB | |
| SCHEMBL17965095 | 0.81 | S1PR1 (0.56) | S1PR1S1PR3HDAC6HDAC3HDAC1 | |
| SCHEMBL17965177 | 0.78 | HTR2B (0.48) | MAPK1MAPTSMN1; SMN2THRBKCNH2 | |
| SCHEMBL17965205 | 0.74 | GPR119 (0.46) | S1PR1S1PR3HDAC6IKBKETBK1 | |
| SCHEMBL25167312 | 0.74 | HDAC4 (0.58) | MAPTNPC1RAB9ASMN1; SMN2THRB | |
| SCHEMBL17965061 | 0.73 | NPC1 (0.48) | S1PR1S1PR3HDAC6HDAC3HDAC1 | |
| SCHEMBL14243230 | 0.73 | THRB (0.50) | MAPK1MAPTSMN1; SMN2THRB | |
| SCHEMBL17965098 | 0.73 | MGLL (0.49) | S1PR1S1PR3HDAC6HDAC3HDAC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2718279-B1 | NOVEL COMPOUNDS AS MODULATORS OF GPR-119 | RHIZEN PHARMACEUTICALS SA (CH) | 2016-08-10 | — | — | EP | claimed |