Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 8/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | BCL2 | P10415 | 5/20 | 0.35 |
| ▸ | BECN1 | Q14457 | 4/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.34 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1235939 | 0.79 | TLR8 (0.48) | BACE1AAK1TLR8NPC1RECQL | |
| SCHEMBL30006352 | 0.79 | TLR8 (0.48) | BACE1AAK1TLR8NPC1RECQL | |
| SCHEMBL16592818 | 0.77 | TLR8 (0.41) | BACE1AAK1TLR8NPC1RECQL | |
| SCHEMBL2333056 | 0.75 | TLR8 (0.51) | BACE1AAK1TLR8SMN1; SMN2BCL2 | |
| SCHEMBL16592799 | 0.73 | TLR8 (0.42) | BACE1AAK1TLR8NPC1RECQL | |
| SCHEMBL17843455 | 0.73 | TLR8 (0.68) | TLR8 | |
| SCHEMBL21098144 | 0.72 | TLR8 (0.48) | BACE1AAK1TLR8BCL2BECN1 | |
| SCHEMBL22306538 | 0.70 | USP30 (0.40) | BACE1AAK1TLR8BCL2BECN1 | |
| SCHEMBL29260333 | 0.69 | NPC1 (0.30) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28473589 | 0.68 | NOS3 (0.34) | BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108055842-B | Sulfinylphenyl or sulfonimidoylphenyl benzazepine idle | 豪夫迈·罗氏有限公司 | 2021-06-29 | — | — | CN | disclosed |
| CN-107148417-B | Benzazepine sulfonamide compounds | 豪夫迈·罗氏有限公司 | 2020-09-08 | — | — | CN | disclosed |