Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 8/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.47 |
| ▸ | MEN1 | O00255 | 6/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 5/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | HKDC1 | Q2TB90 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | XBP1 | P17861 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.43 |
| ▸ | DAPK1 | P53355 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | RECQL | P46063 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30030177 | 0.80 | ADORA2A (0.68) | ADORA2AMAPTKMT2AMEN1NPC1 | |
| SCHEMBL9861717 | 0.78 | ADORA2A (0.69) | ADORA2AMAPTKMT2AMEN1NPC1 | |
| SCHEMBL11303111 | 0.77 | ADORA2A (0.68) | ADORA2AMAPTKMT2AMEN1NPC1 | |
| SCHEMBL27727186 | 0.76 | DAPK1 (0.47) | ADORA2AMAPTKMT2AMEN1NPC1 | |
| SCHEMBL11226616 | 0.76 | PGAM1 (0.54) | ADORA2AMAPTKMT2AMEN1POLB | |
| SCHEMBL1764840 | 0.76 | ADORA2A (0.66) | ADORA2AMAPTKMT2AMEN1NPC1 | |
| SCHEMBL159669 | 0.76 | PGAM1 (0.56) | ADORA2AMAPTKMT2AMEN1NPC1 | |
| SCHEMBL29643579 | 0.76 | PGAM1 (0.56) | ADORA2AMAPTKMT2AMEN1NPC1 | |
| SCHEMBL11231093 | 0.76 | MAPT (0.46) | ADORA2AMAPTKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL5246506 | 0.74 | PGAM1 (0.54) | ADORA2AMAPTKMT2AMEN1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4342700-A | SALTS OF SUBSTITUTED ANTHRAQUINONESULFONIC ACID | MITSUI TOATSU CHEMICALS, INC. (JP) | 1982-08-03 | — | — | US | disclosed |
| US-4276187-A | SALT OF AN ANTHRAQUINONESULFONIC ACID AND SODIUM METAVANADATE | MITSUI TOATSU CHEMICALS INCORPORATED (JP) | 1981-06-30 | — | — | US | disclosed |