Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 7/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.40 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6171950 | 0.82 | HSD17B3 (0.36) | SMN1; SMN2NPC1RAB9ATRPM8GAA | |
| SCHEMBL1897109 | 0.81 | GAA (0.43) | SMN1; SMN2NPC1RAB9AGAAMAPT | |
| SCHEMBL6173888 | 0.78 | HSD17B3 (0.35) | NPC1RAB9AMAPTHPGDKDM4E | |
| SCHEMBL30025878 | 0.74 | MEN1 (0.42) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL10576926 | 0.70 | MAOA (0.35) | SMN1; SMN2NPC1RAB9AGAAHPGD | |
| SCHEMBL10226370 | 0.69 | NPC1 (0.78) | SMN1; SMN2NPC1TP53RAB9ANAMPT | |
| SCHEMBL10370451 | 0.65 | MAOA (0.35) | SMN1; SMN2NPC1TP53RAB9AMAPT | |
| SCHEMBL27529391 | 0.65 | MAOA (0.31) | — | |
| SCHEMBL4420044 | 0.64 | NAMPT (0.44) | SMN1; SMN2NPC1RAB9AMAPTNAMPT | |
| SCHEMBL8553422 | 0.64 | CYP2C9 (0.45) | SMN1; SMN2NPC1TP53RAB9ACYP2C9 |
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-7947833-B2 | methods that are useful in the preparation of amidophenyl-sulfonylamino-quinoxaline compounds CCK2 modulators are disclosed by sulfonylation | JANSSEN PHARMACEUTICA NV (BE) | 2011-05-24 | — | — | US | disclosed |