Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17226058 | 0.89 | CYP19A1 (0.48) | CYP19A1KDM4ENPC1GAATP53 | |
| SCHEMBL17225764 | 0.83 | CYP19A1 (0.55) | CYP19A1KDM4ENPC1GAATP53 | |
| SCHEMBL16749151 | 0.73 | CYP19A1 (0.56) | CYP19A1NPC1TP53ALOX12MAPK1 | |
| SCHEMBL15936871 | 0.69 | CYP19A1 (0.74) | CYP19A1TP53ALOX12MAPK1L3MBTL1 | |
| SCHEMBL15875618 | 0.68 | CYP19A1 (0.73) | CYP19A1TP53ALOX12MAPK1L3MBTL1 | |
| SCHEMBL9296107 | 0.67 | SMN1; SMN2 (0.76) | CYP19A1KDM4ETP53ALOX12MAPK1 | |
| SCHEMBL6801734 | 0.67 | KDM4E (0.49) | KDM4ENPC1GAAGABRA2LMNA | |
| SCHEMBL15897060 | 0.67 | CYP19A1 (0.54) | CYP19A1KDM4ERECQLKMT2AL3MBTL1 | |
| SCHEMBL22815898 | 0.67 | CYP19A1 (0.48) | CYP19A1KDM4ERECQLKMT2AL3MBTL1 | |
| SCHEMBL3821999 | 0.67 | CYP19A1 (0.66) | CYP19A1NPC1TP53ALOX12MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9173892-B2 | Acadesine derivatives, products and compositions including same, therapeutic uses thereof, and methods for synthesizing same | UNIVERSITE NICE SOPHIA ANTIPOLIS (FR) | 2015-11-03 | — | — | US | disclosed |