Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | DYRK3 | O43781 | 2/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.41 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13586045 | 1.00 | KDM4E (0.44) | KDM4EALDH1A1L3MBTL1HTTPOLB | |
| SCHEMBL8308133 | 0.83 | KDM4E (0.52) | KDM4EALDH1A1L3MBTL1DYRK3DYRK1A | |
| SCHEMBL2164243 | 0.83 | KDM4E (0.52) | KDM4EALDH1A1L3MBTL1DYRK3DYRK1A | |
| SCHEMBL2164241 | 0.83 | KDM4E (0.52) | KDM4EALDH1A1L3MBTL1DYRK3DYRK1A | |
| SCHEMBL5666137 | 0.74 | KDM4E (0.58) | KDM4EALDH1A1L3MBTL1HTTPOLB | |
| SCHEMBL21435730 | 0.74 | ACHE (0.48) | KDM4EALDH1A1L3MBTL1HTTACHE | |
| SCHEMBL5666139 | 0.74 | KDM4E (0.58) | KDM4EALDH1A1L3MBTL1HTTPOLB | |
| Benzaldehyde Oxime SCHEMBL27483361 | 0.72 | KDM4E (0.56) | KDM4EALDH1A1L3MBTL1HTTPOLB | |
| Benzaldehyde Oxime SCHEMBL309201 | 0.72 | — | — | |
| Benzaldehyde Oxime SCHEMBL266504 | 0.72 | — | — |
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-9116147-B2 | Compositions and methods for detection of small molecules using dyes derivatized with analyte responsive receptors in a chemiluminescent assay | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2015-08-25 | — | — | US | disclosed |
| US-9116147-B2 | Compositions and methods for detection of small molecules using dyes derivatized with analyte responsive receptors in a chemiluminescent assay | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2015-08-25 | — | — | US | disclosed |
| US-20090269765-A1 | Compositions And Methods For Detection Of Small Molecules Using Dyes Derivatized with Analyte Responsive Receptors in a Chemiluminescent Assay | NAVY, SECRETARY OF THE, UNITED STATES OF AMERICA OFFICE OF NAVAL RESEARCH | 2009-10-29 | — | — | US | disclosed |