Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 8/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.55 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.52 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3706909 | 1.00 | ABCB1 (0.65) | ABCB1TDP1ABCG2SLC5A1SLC5A2 | |
| SCHEMBL20858974 | 0.92 | ABCB1 (0.57) | ABCB1TDP1ABCG2SLC5A1SLC5A2 | |
| SCHEMBL746760 | 0.92 | ABCB1 (0.54) | ABCB1 | |
| SCHEMBL745647 | 0.92 | ABCB1 (0.54) | ABCB1 | |
| SCHEMBL7030048 | 0.91 | ABCB1 (0.53) | ABCB1 | |
| SCHEMBL13075312 | 0.90 | ABCB1 (0.56) | ABCB1TDP1ABCG2SLC5A1SLC5A2 | |
| SCHEMBL7028459 | 0.90 | ABCB1 (0.56) | ABCB1TDP1ABCG2SLC5A1SLC5A2 | |
| SCHEMBL742054 | 0.90 | ABCB1 (0.63) | ABCB1TDP1ABCG2 | |
| SCHEMBL746215 | 0.89 | ABCB1 (0.67) | ABCB1ABCG2 | |
| SCHEMBL7030123 | 0.85 | ABCB1 (0.57) | ABCB1 |
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-2429292-A1 | COMPOUNDS AND COMPOSITIONS COMPRISING CDK INHIBITORS AND METHODS FOR THE TREATMENT OF CANCER | Georgia State University Research Foundation, Inc. (US) | 2012-03-21 | — | — | EP | claimed |
| WO-2010129858-A1 | COMPOUNDS AND COMPOSITIONS COMPRISING CDK INHIBITORS AND METHODS FOR THE TREATMENT OF CANCER | GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2010-11-11 | — | — | WO | claimed |
| EP-2429292-A1 | COMPOUNDS AND COMPOSITIONS COMPRISING CDK INHIBITORS AND METHODS FOR THE TREATMENT OF CANCER | Georgia State University Research Foundation, Inc. (US) | 2012-03-21 | — | — | EP | disclosed |
| WO-2010129858-A1 | COMPOUNDS AND COMPOSITIONS COMPRISING CDK INHIBITORS AND METHODS FOR THE TREATMENT OF CANCER | GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2010-11-11 | — | — | WO | disclosed |