Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11777592 | 0.88 | HRH3 (0.47) | GAAADORA3ADORA2ARAB9ANPC1 | |
| SCHEMBL11776716 | 0.80 | GAA (0.50) | GAAADORA3ADORA2ARAB9ANPC1 | |
| SCHEMBL11776961 | 0.80 | MEN1 (0.54) | ADORA3SMN1; SMN2MAPTALDH1A1KDM4E | |
| SCHEMBL11775105 | 0.78 | KDM4E (0.69) | GAAADORA3ADORA2ARAB9ANPC1 | |
| SCHEMBL4413382 | 0.75 | NPC1 (0.64) | ADORA3ADORA2ARAB9ANPC1ADORA2B | |
| SCHEMBL11773339 | 0.75 | MEN1 (0.49) | ADORA3RAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL11773736 | 0.75 | MEN1 (0.49) | ADORA3ADORA2ARAB9AADORA2BADORA1 | |
| SCHEMBL11777615 | 0.75 | MEN1 (0.49) | ADORA3SMN1; SMN2MAPTALDH1A1KDM4E | |
| SCHEMBL11775033 | 0.75 | MAP4K4 (0.53) | GAAADORA3ADORA2ARAB9ANPC1 | |
| SCHEMBL11873160 | 0.74 | KMT2A (0.66) | ADORA3RAB9ANPC1SMN1; SMN2MAPT |
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-3987171-A | QUINOXALINE FUNGICIDES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-10-19 | — | — | US | disclosed |