Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 13/20 | 0.45 |
| ▸ | CDK1 | P06493 | 11/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 11/20 | 0.45 |
| ▸ | CCNE2 | O96020 | 4/20 | 0.45 |
| ▸ | FLT3 | P36888 | 4/20 | 0.45 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.45 |
| ▸ | CDK4 | P11802 | 3/20 | 0.45 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.45 |
| ▸ | CCND1 | P24385 | 3/20 | 0.45 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.45 |
| ▸ | PDGFRA | P16234 | 5/20 | 0.41 |
| ▸ | SRC | P12931 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | CDK7 | P50613 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6753817 | 1.00 | CDK2 (0.45) | CDK2CDK1CCNE1CCNE2FLT3 | |
| SCHEMBL6753756 | 0.90 | KMT2A (0.35) | CDK2CDK1CCNE1CCNE2FLT3 | |
| SCHEMBL6751476 | 0.88 | CCNE2 (0.48) | CDK2CDK1CCNE1CCNE2CCNA2 | |
| SCHEMBL6751475 | 0.88 | CCNE2 (0.48) | CDK2CDK1CCNE1CCNE2CCNA2 | |
| SCHEMBL4372748 | 0.81 | CDK2 (0.49) | CDK2CDK1CCNE1CCNE2FLT3 | |
| SCHEMBL4372753 | 0.81 | CDK2 (0.49) | CDK2CDK1CCNE1CCNE2FLT3 | |
| SCHEMBL4372495 | 0.78 | FLT3 (0.55) | CDK2CDK1CCNE1CCNE2FLT3 | |
| SCHEMBL4372328 | 0.78 | FLT3 (0.55) | CDK2CDK1CCNE1CCNE2FLT3 | |
| SCHEMBL4372504 | 0.71 | MERTK (0.39) | CDK2FLT3PDGFRACCNA2JAK1 | |
| SCHEMBL4372507 | 0.71 | MERTK (0.39) | CDK2FLT3PDGFRACCNA2JAK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1377579-A2 | ACYL AND SULFONYL DERIVATIVES OF 6,9-DISUBSTITUTED 2-(TRANS-1,4-DIAMINOCYCLOHEXYL)-PURINES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | Aventis Pharmaceuticals Inc. (US) | 2004-01-07 | — | — | EP | disclosed |
| WO-2002042303-A2 | ACYL AND SULFONYL DERIVATIVES OF 6,9-DISUBSTITUTED 2-(TRANS-1,4-DIAMINOCYCLOHEXYL)-PURINES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | AVENTIS PHARMACEUTICALS INC. (US) | 2002-05-30 | — | — | WO | disclosed |