Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | CCNE1 | P24864 | 10/20 | 0.48 |
| ▸ | CDK2 | P24941 | 10/20 | 0.48 |
| ▸ | CCNE2 | O96020 | 8/20 | 0.48 |
| ▸ | CDK4 | P11802 | 5/20 | 0.47 |
| ▸ | CDK1 | P06493 | 4/20 | 0.47 |
| ▸ | CCND1 | P24385 | 4/20 | 0.47 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.47 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.47 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.47 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.47 |
| ▸ | CCND2 | P30279 | 1/20 | 0.44 |
| ▸ | CCND3 | P30281 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4522999 | 0.82 | CCNE1 (0.59) | SMN1; SMN2CCNE1CDK2CCNE2CDK4 | |
| SCHEMBL186141 | 0.81 | HCAR2 (0.53) | SMN1; SMN2CCNE1CDK2CCNE2CDK4 | |
| SCHEMBL5216255 | 0.79 | CCNE1 (0.46) | SMN1; SMN2ALDH1A1HPGDCCNE1CDK2 | |
| SCHEMBL2370795 | 0.78 | FFAR2 (0.53) | SMN1; SMN2CCNE1CDK2CCNE2CDK4 | |
| SCHEMBL3800102 | 0.77 | CCNE1 (0.54) | SMN1; SMN2ALDH1A1KDM4EHPGDHTT | |
| SCHEMBL13610783 | 0.76 | SMN1; SMN2 (0.59) | SMN1; SMN2ALDH1A1KDM4EHPGDHTT | |
| SCHEMBL13610837 | 0.76 | ALDH1A1 (0.56) | SMN1; SMN2ALDH1A1KDM4EHPGDHTT | |
| SCHEMBL179490 | 0.76 | CCNE1 (0.52) | CCNE1CDK2CCNE2CDK4CDK1 | |
| SCHEMBL4523132 | 0.75 | CCNE1 (0.46) | SMN1; SMN2CCNE1CDK2CCNE2CDK4 | |
| SCHEMBL1350381 | 0.75 | CCNE1 (0.48) | CCNE1CDK2CCNE2CDK4CDK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7645771-B2 | CCR5 antagonists as therapeutic agents | SMITHKLINE BEECHAM CORP. (US) | 2010-01-12 | — | — | US | disclosed |
| US-7645771-B2 | CCR5 antagonists as therapeutic agents | SMITHKLINE BEECHAM CORP. (US) | 2010-01-12 | — | — | US | disclosed |