Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.54 |
| ▸ | MET | P08581 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27033531 | 0.82 | GPR84 (0.61) | MTNR1AADORA2AGPR84METKMT2A | |
| SCHEMBL1362109 | 0.81 | HPGD (0.54) | HTTMTNR1AADORA2AGPR84MET | |
| SCHEMBL27581164 | 0.81 | GPR84 (0.59) | MTNR1AADORA2AGPR84METKMT2A | |
| SCHEMBL7983367 | 0.81 | MTNR1A (0.53) | MTNR1AADORA2AGPR84METKMT2A | |
| SCHEMBL7998339 | 0.80 | MET (0.63) | MTNR1AADORA2AGPR84METKMT2A | |
| SCHEMBL7975613 | 0.80 | TSHR (0.68) | HTTTSHRKMT2AHPGDMAPK1 | |
| SCHEMBL858139 | 0.80 | NPC1 (0.60) | MTNR1AADORA2AGPR84METKMT2A | |
| SCHEMBL858653 | 0.79 | SMN1; SMN2 (0.51) | MTNR1AADORA2AGPR84METKMT2A | |
| SCHEMBL857650 | 0.79 | HPGD (0.51) | HTTMTNR1ATSHRADORA2AGPR84 | |
| SCHEMBL878897 | 0.78 | NPC1 (0.56) | HTTMTNR1AADORA2AGPR84MET |
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-2709622-A2 | KINASE MODULATION AND INDICATIONS THEREFOR | PLEXXIKON INC. (US) | 2014-03-26 | — | — | EP | disclosed |
| WO-2012158957-A2 | KINASE MODULATION AND INDICATIONS THEREFOR | PLEXXIKON INC. (US) | 2012-11-22 | — | — | WO | disclosed |