Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 2/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | ROS1 | P08922 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9651557 | 1.00 | PGR (0.54) | PGREPHX2POLBROS1CDK5 | |
| SCHEMBL13091038 | 0.85 | PGR (0.46) | PGREPHX2POLBROS1CDK5 | |
| SCHEMBL24112743 | 0.85 | PGR (0.46) | PGREPHX2POLBROS1CDK5 | |
| SCHEMBL11461344 | 0.81 | ROS1 (0.45) | PGREPHX2ROS1CDK5ACVR1 | |
| SCHEMBL2263637 | 0.79 | PGR (0.53) | PGRCA12CA1CA2CA4 | |
| SCHEMBL24112727 | 0.79 | PGR (0.53) | PGRCA12CA1CA2CA4 | |
| SCHEMBL24112733 | 0.79 | PGR (0.69) | PGRPOLBKMT2AMEN1GAA | |
| SCHEMBL29891547 | 0.79 | PGR (0.53) | PGRPOLBBRD4ALDH1A1 | |
| SCHEMBL3519770 | 0.79 | PGR (0.53) | PGRPOLBBRD4ALDH1A1 | |
| SCHEMBL948578 | 0.79 | PGR (0.69) | PGRPOLBKMT2AMEN1GAA |
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-2021252644-A1 | INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF | Pardes Biosciences, Inc. (US) | 2021-12-16 | — | — | WO | disclosed |