Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CMA1 | P23946 | 1/20 | 0.51 |
| ▸ | AHR | P35869 | 1/20 | 0.51 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.45 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | TGM2 | P21980 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13729447 | 0.93 | CMA1 (0.51) | CMA1AHRPARP10PARP11PARP1 | |
| SCHEMBL22278373 | 0.83 | CMA1 (0.56) | CMA1AHRKMT2AMEN1TGM2 | |
| SCHEMBL6959254 | 0.79 | AHR (0.51) | CMA1AHRPARP10PARP1KMT2A | |
| SCHEMBL19203466 | 0.79 | CA9 (0.59) | KMT2AMEN1CRBN | |
| SCHEMBL6970657 | 0.79 | EPHX2 (0.49) | PARP10PARP11PARP1CRBNBRD4 | |
| SCHEMBL30697324 | 0.79 | PARP1 (0.45) | PARP10PARP1KMT2AMEN1CDK2 | |
| SCHEMBL29126120 | 0.79 | PARP1 (0.45) | PARP10PARP1KMT2AMEN1CDK2 | |
| SCHEMBL31734661 | 0.77 | AHR (0.69) | CMA1AHRKMT2AMEN1CDK2 | |
| SCHEMBL384362 | 0.76 | KDM4E (0.48) | CMA1AHRPARP10PARP11PARP1 | |
| SCHEMBL1119397 | 0.76 | CMA1 (0.56) | CMA1AHRKMT2AMEN1TGM2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024046361-A1 | AZEPINE FUSED RING COMPOUND AS RIPK1 INHIBITOR AND USE THEREOF | 科辉智药生物科技（无锡）有限公司 | 2024-03-07 | — | — | WO | disclosed |