Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.48 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.43 |
| ▸ | TDO2 | P48775 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.43 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6322290 | 0.85 | TRPA1 (0.59) | TRPA1PIK3CDMAPK14PIK3CBPIK3CG | |
| SCHEMBL28625537 | 0.80 | MAPK14 (0.44) | TDO2MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL29432338 | 0.79 | MAPK14 (0.43) | TDO2MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL19072688 | 0.72 | MAPK14 (0.48) | MAPK14MAPK13MAPK12MAPK11AKT1 | |
| SCHEMBL4864309 | 0.72 | AKT1 (0.39) | TDO2MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL4864249 | 0.71 | AKT1 (0.41) | MAPK14MAPK13MAPK12MAPK11CYP1A2 | |
| SCHEMBL20540332 | 0.70 | PIK3CD (0.64) | PIK3CDMAPK14PIK3CBPIK3CGMAPK1 | |
| SCHEMBL19100765 | 0.69 | PIK3CD (0.61) | PIK3CDMAPK14PIK3CBPIK3CGPIK3CA | |
| SCHEMBL6330094 | 0.69 | MAPK14 (0.53) | TRPA1PIK3CDMAPK14PIK3CBPIK3CG | |
| SCHEMBL4073675 | 0.69 | CYP11B2 (0.51) | MAPK14CYP1A2CYP3A4TGFBR1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7816016-B1 | hexacoordinated Indium complex made of ligand 1,1-bis(trifluoromethyl)-2-(diphenylphosphino)-ethanol and bis-cyclometallated Ir 2-(2,4-difluoro-3-perfluoroisopropyl-phenyl)-4-carbazolyl-pyridine | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-10-19 | — | — | US | disclosed |
| US-7320835-B2 | Phosphorescent material | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2008-01-22 | — | — | US | disclosed |
| US-20050196637-A1 | Phosphorescent material | LG CHEM, LTD. (KR) | 2005-09-08 | — | — | US | disclosed |