Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 9/20 | 0.69 |
| ▸ | CDK2 | P24941 | 3/20 | 0.63 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.63 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.63 |
| ▸ | CDK1 | P06493 | 2/20 | 0.60 |
| ▸ | CTSB | P07858 | 1/20 | 0.60 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | TMIGD3 | P0DMS9 | 2/20 | 0.56 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.56 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.56 |
| ▸ | PDE2A | O00408 | 1/20 | 0.54 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.53 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.53 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6817859 | 0.91 | CDK1 (0.74) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL17628578 | 0.89 | CDK1 (0.65) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL6944109 | 0.89 | CCNE2 (0.76) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL27581375 | 0.88 | CTSL (0.63) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL17639878 | 0.88 | PDE2A (0.58) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL5828677 | 0.84 | CTSL (0.58) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL6945059 | 0.84 | CCNE2 (0.57) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL5827932 | 0.84 | CTSL (0.58) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL17628618 | 0.83 | CDK1 (0.57) | CTSLCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL6820865 | 0.82 | PPARG (0.65) | ADORA2AADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1150982-B1 | PURINE INHIBITORS OF CYCLIN DEPENDENT KINASE 2 AND IkB-alpha | CV THERAPEUTICS INC (US) | 2005-10-12 | — | — | EP | disclosed |