Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 12/20 | 0.80 |
| ▸ | CDK5R1 | Q15078 | 12/20 | 0.80 |
| ▸ | NPC1 | O15118 | 1/20 | 0.80 |
| ▸ | POLB | P06746 | 1/20 | 0.80 |
| ▸ | CCNA2 | P20248 | 11/20 | 0.55 |
| ▸ | CDK2 | P24941 | 11/20 | 0.55 |
| ▸ | CCNA1 | P78396 | 10/20 | 0.55 |
| ▸ | DYRK1A | Q13627 | 8/20 | 0.55 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.52 |
| ▸ | CDK1 | P06493 | 4/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 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 | |
|---|---|---|---|---|
| SCHEMBL5193365 | 0.91 | CDK5 (0.78) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL23494096 | 0.89 | CDK5 (1.00) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL31307877 | 0.89 | CDK5 (1.00) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL5626927 | 0.88 | CDK5 (0.63) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL5193529 | 0.87 | CDK5 (0.62) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL5196103 | 0.80 | CDK5 (0.53) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL5192977 | 0.79 | FLT3 (0.64) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL7457997 | 0.79 | FLT3 (0.64) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL5630231 | 0.79 | CDK5 (0.61) | CDK5CDK5R1NPC1POLBCCNA2 | |
| SCHEMBL5193482 | 0.77 | CDK5 (0.60) | CDK5CDK5R1NPC1POLBCCNA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1183256-B1 | PURINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | AVENTIS PHARMA SA (FR) | 2007-08-22 | — | — | EP | disclosed |
| US-7122669-B1 | Purine derivatives, preparation method and pharmaceutical compositions containing same | HOECHST MARION ROUSSEL (FR) | 2006-10-17 | — | — | US | disclosed |
| EP-1183256-A1 | PURINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | Aventis Pharma S.A. (FR) | 2002-03-06 | — | — | EP | disclosed |
| WO-2000071543-A1 | PURINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | AVENTIS PHARMA S.A. (FR) | 2000-11-30 | — | — | WO | disclosed |