Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.59 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.56 |
| ▸ | PARP1 | P09874 | 1/20 | 0.56 |
| ▸ | BRD4 | O60885 | 2/20 | 0.49 |
| ▸ | METAP1 | P53582 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | TYMS | P04818 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL354988 | 1.00 | PBRM1 (0.59) | PBRM1PARP10PARP1BRD4METAP1 | |
| SCHEMBL21234894 | 0.88 | METAP1 (0.55) | PBRM1PARP10PARP1BRD4METAP1 | |
| SCHEMBL29673118 | 0.88 | MAOA (0.59) | PBRM1PARP10PARP1METAP1ACHE | |
| SCHEMBL1274936 | 0.88 | MAOA (0.59) | PBRM1PARP10PARP1METAP1ACHE | |
| SCHEMBL10177012 | 0.88 | MAOA (0.59) | PBRM1PARP10PARP1METAP1ACHE | |
| SCHEMBL14925847 | 0.84 | METAP1 (0.60) | PARP10PARP1METAP1ACHETYMS | |
| SCHEMBL5208267 | 0.84 | BRD4 (0.55) | PBRM1PARP10PARP1BRD4TYMS | |
| SCHEMBL5929505 | 0.83 | CYP2A6 (0.58) | PBRM1PARP10PARP1BRD4METAP1 | |
| SCHEMBL29726014 | 0.83 | CASP1 (0.59) | PBRM1PARP10PARP1METAP1MAOA | |
| SCHEMBL423287 | 0.83 | CASP1 (0.59) | PBRM1PARP10PARP1METAP1MAOA |
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-116940552-A | Spirocyclic hexane derivatives, pharmaceutical compositions containing them and their use as anti-apoptotic inhibitors | 法国施维雅药厂 | 2023-10-24 | — | — | CN | disclosed |
| WO-2023122754-A1 | PROCESSES AND INTERMEDIATES FOR PREPARING GB13, GB22 AND HIMGALINE | THE SCRIPPS RESEARCH INSTITUTE (US) | 2023-06-29 | — | — | WO | disclosed |