Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.47 |
| ▸ | CDK1 | P06493 | 2/20 | 0.47 |
| ▸ | CDK4 | P11802 | 2/20 | 0.47 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.47 |
| ▸ | CCND1 | P24385 | 2/20 | 0.47 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | ERN1 | O75460 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL26124646 | 1.00 | ALOX5 (0.54) | ALOX5RAB9ANPC1MAOAMAOB | |
| SCHEMBL13523860 | 0.84 | MAOB (0.51) | ALOX5RAB9ANPC1MAOAMAOB | |
| SCHEMBL21822484 | 0.82 | RAB9A (0.41) | ALOX5RAB9ANPC1MAPTSMN1; SMN2 | |
| SCHEMBL23796751 | 0.81 | MAOB (0.57) | ALOX5MAOAMAOBL3MBTL1CCNB2 | |
| SCHEMBL19660281 | 0.78 | MAOA (0.51) | ALOX5RAB9ANPC1MAOAMAOB | |
| SCHEMBL8050543 | 0.78 | GAA (0.52) | RAB9ANPC1MAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL8327914 | 0.78 | MAOA (0.61) | ALOX5RAB9ANPC1MAOAMAOB | |
| SCHEMBL13886669 | 0.78 | KMT2A (0.49) | RAB9ANPC1MAPTL3MBTL1KMT2A | |
| SCHEMBL27432917 | 0.77 | MEN1 (0.49) | ALOX5RAB9ANPC1MAOAMAOB | |
| SCHEMBL4483973 | 0.77 | ALOX5 (0.59) | ALOX5RAB9ANPC1MAOAMAOB |
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-114057744-B | Process for preparing KRAS G12C inhibitors imidazotriazines and pyrrolopyrimidine derivatives | 百济神州(北京)生物科技有限公司 | 2025-01-17 | — | — | CN | disclosed |
| CN-114057744-A | Process for preparing imidazotriazine and pyrrolopyrimidine derivatives as inhibitors of KRAS G12C | 百济神州(北京)生物科技有限公司 | 2022-02-18 | — | — | CN | disclosed |
| WO-2022028492-A1 | IMIDAZOTRIAZINE AND PYRROLOPYRIMIDINE DERIVATIVES AS KRAS G12C INHIBITORS | BEIGENE, LTD. (KY) | 2022-02-10 | — | — | WO | disclosed |