Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 5/20 | 0.67 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.67 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.67 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.67 |
| ▸ | GRM5 | P41594 | 3/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | CDK1 | P06493 | 3/20 | 0.48 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | CDK4 | P11802 | 3/20 | 0.44 |
| ▸ | BTK | Q06187 | 2/20 | 0.44 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23021156 | 0.87 | CDK2 (0.63) | CDK2CDK5CDK5R1CCNA2GRM5 | |
| SCHEMBL22999621 | 0.86 | CDK5 (0.51) | CDK2CDK5CDK5R1CCNA2CDK1 | |
| SCHEMBL9959309 | 0.86 | CDK5 (0.49) | CDK2CDK5CDK5R1CCNA2GRM5 | |
| Hydrochloric Acid SCHEMBL22999614 | 0.86 | CDK2 (0.62) | CDK2CDK5CDK5R1CCNA2GRM5 | |
| SCHEMBL17620607 | 0.86 | CDK5 (0.65) | CDK2CDK5CDK5R1CCNA2GRM5 | |
| SCHEMBL9959983 | 0.86 | CDK5 (0.69) | CDK2CDK5CDK5R1CCNA2GRM5 | |
| SCHEMBL9959907 | 0.85 | CDK5 (0.70) | CDK2CDK5CDK5R1CCNA2GRM5 | |
| SCHEMBL2793592 | 0.84 | CDK2 (0.48) | CDK2CDK5CDK5R1CCNA2GRM5 | |
| SCHEMBL2793739 | 0.81 | CDK5 (0.52) | CDK2CDK5CDK5R1CCNA2GRM5 | |
| SCHEMBL22999790 | 0.79 | CDK5 (0.55) | CDK2CDK5CDK5R1CCNA2GRM5 |
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-2012085167-A1 | METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2012-06-28 | — | — | WO | disclosed |