Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE1 | P24864 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 2/20 | 0.40 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | AGBL2 | Q5U5Z8 | 2/20 | 0.39 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.38 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL18606443 | 0.98 | CCNE2 (0.41) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL22015494 | 0.82 | CCNE1 (0.44) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL22723848 | 0.81 | CCNE1 (0.40) | CCNE1CDK2CCNE2CDK4CCND1 | |
| Acetic Acid SCHEMBL27649212 | 0.79 | CCNE2 (0.43) | CCNE1CDK2CCNE2CDK4CCND1 | |
| Potassium Ion SCHEMBL22711543 | 0.79 | CCNE1 (0.40) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL4632525 | 0.79 | RXRA (0.54) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL23331071 | 0.78 | CCNE1 (0.42) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL12307578 | 0.78 | CCNE1 (0.42) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL24689836 | 0.77 | CCNE1 (0.41) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL1706369 | 0.76 | FAAH (0.41) | AGBL2P4HTMGABRR1FAAHNR4A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111801330-A | Fused ring compounds having dopamine D3 receptor antagonism | 盐野义制药株式会社 | 2020-10-20 | — | — | CN | disclosed |