Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 8/20 | 0.40 |
| ▸ | CCND1 | P24385 | 8/20 | 0.40 |
| ▸ | CCNE2 | O96020 | 4/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.40 |
| ▸ | CDK2 | P24941 | 4/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 4/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.37 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.37 |
| ▸ | GSK3A | P49840 | 2/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.36 |
| ▸ | WEE1 | P30291 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.36 |
| ▸ | PRKCG | P05129 | 2/20 | 0.36 |
| ▸ | PRKCB | P05771 | 2/20 | 0.36 |
| ▸ | CDK1 | P06493 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9556428 | 0.81 | CDK4 (0.39) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL15557199 | 0.80 | CDK4 (0.41) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL4422539 | 0.78 | SLC6A4 (0.47) | CDK4CCND1GSK3BCHEK1WEE1 | |
| SCHEMBL17045728 | 0.76 | CDK4 (0.37) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL1756365 | 0.76 | TRPM4 (0.48) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL8853276 | 0.76 | CDK4 (0.40) | CDK4CCND1GPR84GSK3BCDK5 | |
| SCHEMBL789452 | 0.75 | TRPM4 (0.47) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL29128557 | 0.74 | CDK4 (0.39) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL27814900 | 0.74 | NPC1 (0.55) | CDK4CCND1GSK3BDHODHKMT2A | |
| SCHEMBL7767469 | 0.73 | MEN1 (0.50) | CDK4GPR84CHEK1WEE1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6096758-A | 3-METHYLIMIDAZOPYRIDINES USED FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 2000-08-01 | — | — | US | disclosed |