Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.36 |
| ▸ | MME | P08473 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.33 |
| ▸ | MTOR | P42345 | 2/20 | 0.33 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.31 |
| ▸ | FEN1 | P39748 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7214964 | 0.81 | ALDH1A1 (0.40) | KDM4EALDH1A1MMEPIK3CARXFP1 | |
| SCHEMBL20889598 | 0.81 | ALDH1A1 (0.36) | KDM4EALDH1A1MMEPIK3CAPIK3CD | |
| SCHEMBL27430993 | 0.78 | POLA1 (0.39) | KDM4EALDH1A1PKMALOX5APFEN1 | |
| SCHEMBL23420495 | 0.77 | MME (0.34) | KDM4EALDH1A1MMEPIK3CAPIK3CD | |
| SCHEMBL29658121 | 0.77 | ALDH1A1 (0.33) | KDM4EALDH1A1MMEPIK3CAPIK3CD | |
| SCHEMBL18393529 | 0.74 | POLA1 (0.45) | MAPTTDP1 | |
| SCHEMBL3229989 | 0.71 | KDM4E (0.50) | KDM4EALDH1A1PIK3CAPIK3CDPIK3CB | |
| SCHEMBL28013794 | 0.70 | ALOX5AP (0.31) | ALOX5APFEN1 | |
| SCHEMBL21906548 | 0.69 | ALDH1A1 (0.39) | KDM4EALDH1A1PIK3CARXFP1PIK3CD | |
| SCHEMBL620396 | 0.69 | SMN1; SMN2 (0.48) | KDM4EALDH1A1PIK3CAPKMPIK3CD |
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 |