Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.30 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 2/20 | 0.30 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | FYN | P06241 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | AHR | P35869 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16484883 | 0.88 | TNF (0.43) | TNFDYRK1AKDM4EALDH1A1MAPT | |
| SCHEMBL16484905 | 0.86 | TNF (0.40) | TNFPIK3CDPIK3CBPIK3CGDYRK1A | |
| SCHEMBL16484912 | 0.86 | TNF (0.41) | TNFDYRK1ACDK4CDK6CYP1A2 | |
| SCHEMBL16483553 | 0.85 | ALDH1A1 (0.35) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL16483721 | 0.84 | ALK (0.31) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL16484857 | 0.84 | TNF (0.39) | TNFDYRK1ACDK4CDK6CYP1A2 | |
| SCHEMBL16484935 | 0.83 | TNF (0.42) | TNFDYRK1ACDK4CDK6KDM4E | |
| SCHEMBL14330575 | 0.83 | CDK4 (0.35) | TNFDYRK1AHASPINCDK4CDK6 | |
| SCHEMBL16483509 | 0.83 | TNF (0.38) | TNFHASPIN | |
| SCHEMBL16484867 | 0.83 | TNF (0.37) | TNFPIK3CDPIK3CBPIK3CGDYRK1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014057873-A1 | PHOSPHINE OXIDE DERIVATIVE AND LIGHT-EMITTING ELEMENT PROVIDED WITH SAME | 東レ株式会社 (JP) | 2014-04-17 | — | — | WO | disclosed |