Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | CBFB | Q13951 | 5/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | ACP1 | P24666 | 1/20 | 0.41 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9619825 | 0.87 | NPSR1 (0.53) | ALDH1A1KDM4EHPGDMAPTALOX15 | |
| SCHEMBL26563559 | 0.84 | ALDH1A1 (0.58) | ALDH1A1KDM4EHPGDMAPTALOX15 | |
| SCHEMBL15110815 | 0.84 | ALDH1A1 (0.58) | ALDH1A1KDM4EHPGDMAPTALOX15 | |
| SCHEMBL22912817 | 0.79 | KDM4E (0.57) | ALDH1A1KDM4EHPGDMAPTALOX15 | |
| SCHEMBL6373903 | 0.79 | PKM (0.57) | ALDH1A1KDM4EHPGDMAPTALOX15 | |
| SCHEMBL29396642 | 0.79 | KDM4E (0.57) | ALDH1A1KDM4EHPGDMAPTALOX15 | |
| SCHEMBL19970794 | 0.77 | NPBWR1 (0.67) | CBFBKCNH2NPBWR1 | |
| SCHEMBL10694441 | 0.76 | KDM4E (0.65) | ALDH1A1KDM4EHPGDMAPTALOX15 | |
| SCHEMBL727388 | 0.75 | PLAU (0.61) | ALDH1A1ALOX15CBFBTDP1S1PR1 | |
| SCHEMBL6467818 | 0.75 | CBFB (0.52) | ALDH1A1ALOX15CYP1A2NPSR1CBFB |
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-2078018-A1 | HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS | Signal Pharmaceuticals LLC (US) | 2009-07-15 | — | — | EP | disclosed |
| WO-2008051494-A1 | HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS | SIGNAL PHARMACEUTICALS, LLC (US) | 2008-05-02 | — | — | WO | disclosed |