Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PREP | P48147 | 7/20 | 0.48 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | VNN1 | O95497 | 1/20 | 0.47 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL81979 | 1.00 | PREP (0.48) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL28528114 | 1.00 | PREP (0.48) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL25848040 | 0.89 | SMN1; SMN2 (0.52) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL80752 | 0.85 | SPHK2 (0.54) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL1190565 | 0.85 | SPHK2 (0.54) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL3605585 | 0.85 | SPHK2 (0.54) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL13961188 | 0.84 | SMN1; SMN2 (0.52) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL14646609 | 0.84 | NPC1 (0.60) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL7561453 | 0.84 | SPHK2 (0.53) | PREPFKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL5305188 | 0.84 | SMN1; SMN2 (0.52) | PREPFKBP1ASMN1; SMN2NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118339153-A | Heteroaromatic compounds for the treatment of cancer | 勃林格殷格翰国际有限公司 | 2024-07-12 | — | — | CN | disclosed |
| CN-112430234-B | Novel KRAS G12C protein inhibitor and preparation method and application thereof | 信达生物制药(苏州)有限公司 | 2023-04-28 | — | — | CN | disclosed |
| CN-112430234-A | Novel KRAS G12C protein inhibitor and preparation method and application thereof | 信达生物制药(苏州)有限公司 | 2021-03-02 | — | — | CN | disclosed |