Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.66 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | SCD | O00767 | 1/20 | 0.55 |
| ▸ | NPBWR1 | P48145 | 3/20 | 0.55 |
| ▸ | TNKS | O95271 | 2/20 | 0.52 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.52 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | METAP2 | P50579 | 1/20 | 0.50 |
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13118022 | 0.98 | HDAC6 (0.68) | HDAC6NPC1RAB9AGAASCD | |
| SCHEMBL10256934 | 0.86 | NPBWR1 (0.73) | HDAC6NPC1RAB9AGAASCD | |
| SCHEMBL25110163 | 0.85 | HDAC6 (0.57) | HDAC6NPC1RAB9ASCDNPBWR1 | |
| SCHEMBL22600132 | 0.85 | SCD (0.53) | HDAC6NPC1RAB9AGAASCD | |
| SCHEMBL4192687 | 0.84 | DGAT1 (0.74) | HDAC6NPC1RAB9AGAASCD | |
| SCHEMBL24074323 | 0.84 | HDAC6 (0.60) | HDAC6SCDNPBWR1DGAT1KCNH2 | |
| SCHEMBL1610237 | 0.84 | HDAC6 (0.60) | HDAC6NPC1RAB9AGAASCD | |
| SCHEMBL29091542 | 0.83 | NPBWR1 (0.78) | HDAC6NPC1RAB9AGAANPBWR1 | |
| SCHEMBL30615051 | 0.83 | NPBWR1 (0.78) | HDAC6NPC1RAB9AGAANPBWR1 | |
| SCHEMBL15946406 | 0.83 | NPC1 (0.57) | HDAC6NPC1RAB9AGAANPBWR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2627652-B1 | PYRIDYL BENZOXAZINE DERIVATIVES, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE THEREOF | DAE WOONG PHARMA (KR) | 2015-12-16 | — | — | EP | disclosed |
| EP-2627652-A2 | NOVEL PYRIDYL BENZOXAZINE DERIVATIVES, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE THEREOF | Daewoong Pharmaceutical Co., Ltd (KR) | 2013-08-21 | — | — | EP | disclosed |
| WO-2012050380-A2 | NOVEL PYRIDYL BENZOXAZINE DERIVATIVES, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE THEREOF | DAEWOONG PHARMACEUTICAL CO., LTD. (KR) | 2012-04-19 | — | — | WO | disclosed |
| US-8026235-B1 | Pyridyl benzoxazine derivatives, pharmaceutical composition comprising the same, and use thereof | DAEWOONG PHARMACEUTICAL CO., LTD. (KR) | 2011-09-27 | — | — | US | disclosed |