Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP11 | Q9NR21 | 9/20 | 0.52 |
| ▸ | PARP10 | Q53GL7 | 9/20 | 0.49 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 6/20 | 0.40 |
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27446376 | 0.88 | PARP11 (0.55) | PARP11PARP10HTR2CHTR2BHTR2A | |
| SCHEMBL19838605 | 0.82 | PARP11 (0.55) | PARP11PARP10GSK3BGRM5PARP1 | |
| SCHEMBL19852063 | 0.81 | PARP11 (0.51) | PARP11PARP10GSK3BPARP1 | |
| SCHEMBL8255407 | 0.79 | PARP10 (0.59) | PARP11PARP10HTR2CHTR2BHTR2A | |
| SCHEMBL10911695 | 0.78 | KDM4E (0.55) | HTR2CHTR2BHTR2A | |
| SCHEMBL10168733 | 0.78 | PARP11 (0.66) | PARP11PARP10GRM5PARP1PDPK1 | |
| SCHEMBL23777279 | 0.78 | PARP11 (0.55) | PARP11PARP10GSK3BGRM5 | |
| SCHEMBL12090727 | 0.76 | PARP10 (0.81) | PARP11PARP10GSK3BGRM5PARP1 | |
| SCHEMBL23160638 | 0.75 | PARP1 (0.49) | PARP11PARP10GSK3BGRM5PARP1 | |
| SCHEMBL19386434 | 0.75 | PARP11 (0.61) | PARP11PARP10GRM5PARP1PDPK1 |
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-2024119122-A1 | CDK INHIBITORS AND METHODS AND USE THEREOF | RELAY THERAPEUTICS, INC. (US) | 2024-06-06 | — | — | WO | disclosed |