Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.38 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.38 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | HASPIN | Q8TF76 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL256355 | 0.76 | HASPIN (0.43) | DYRK1ANFATC1GSK3BHASPINLMNA | |
| SCHEMBL15935200 | 0.71 | HASPIN (0.37) | DYRK1ANFATC1GSK3BHASPINLMNA | |
| SCHEMBL24668531 | 0.68 | HASPIN (0.35) | DYRK1AGSK3BHASPINCYP1A2CYP2D6 | |
| SCHEMBL152013 | 0.68 | CYP19A1 (0.45) | HTTDYRK1ALMNACYP1A2CYP3A4 | |
| SCHEMBL19270203 | 0.67 | KDM4C (0.36) | USP2HTTNCOA1NCOA3DYRK1A | |
| SCHEMBL19270204 | 0.67 | KDM4C (0.39) | USP2HTTNCOA1NCOA3DYRK1A | |
| Benzene SCHEMBL27941073 | 0.66 | PRKCZ (0.45) | HTTDYRK1AHASPINLMNACYP1A2 | |
| SCHEMBL30912787 | 0.66 | CYP19A1 (0.49) | DYRK1ACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL140144 | 0.66 | PRKCZ (0.48) | HTTDYRK1AHASPINLMNACYP1A2 | |
| SCHEMBL31613470 | 0.66 | PRKCZ (0.48) | HTTDYRK1AHASPINLMNACYP1A2 |
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-2022187693-A1 | COVALENT CDK2-BINDING COMPOUNDS FOR THERAPEUTIC PURPOSES | UMBRA THERAPEUTICS INC. (US) | 2022-09-09 | — | — | WO | disclosed |