Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 9/20 | 0.74 |
| ▸ | CDK5R1 | Q15078 | 9/20 | 0.74 |
| ▸ | CCNA2 | P20248 | 7/20 | 0.74 |
| ▸ | CDK2 | P24941 | 7/20 | 0.74 |
| ▸ | GRM5 | P41594 | 5/20 | 0.74 |
| ▸ | CDK1 | P06493 | 2/20 | 0.59 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.59 |
| ▸ | MAOB | P27338 | 2/20 | 0.59 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.53 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.53 |
| ▸ | CCND3 | P30281 | 1/20 | 0.53 |
| ▸ | FLT3 | P36888 | 1/20 | 0.53 |
| ▸ | CDK9 | P50750 | 1/20 | 0.53 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.53 |
| ▸ | AURKA | O14965 | 1/20 | 0.53 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9959938 | 0.85 | GRM5 (1.00) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL9959836 | 0.84 | CDK5 (1.00) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL23656974 | 0.80 | GRM5 (0.72) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL9959309 | 0.80 | CDK5 (0.49) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL23020744 | 0.78 | AURKA (0.51) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| Hydrochloric Acid SCHEMBL23000039 | 0.77 | AURKA (0.50) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL11299433 | 0.75 | IKBKB (0.71) | CDK5CDK5R1CCNA2CDK2AURKA | |
| SCHEMBL9960032 | 0.74 | GRM5 (1.00) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL12498045 | 0.74 | MAPK1 (0.58) | CDK5CDK5R1CDK2MAPTMAPK1 | |
| SCHEMBL12609744 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012085166-A1 | METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2012-06-28 | — | — | WO | claimed |
| WO-2012085166-A1 | METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2012-06-28 | — | — | WO | disclosed |