Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK7 | P50613 | 20/20 | 0.70 |
| ▸ | CCNH | P51946 | 12/20 | 0.63 |
| ▸ | CCNT1 | O60563 | 11/20 | 0.63 |
| ▸ | CDK9 | P50750 | 11/20 | 0.63 |
| ▸ | MNAT1 | P51948 | 10/20 | 0.63 |
| ▸ | CCNK | O75909 | 9/20 | 0.63 |
| ▸ | CDK12 | Q9NYV4 | 9/20 | 0.63 |
| ▸ | CDK13 | Q14004 | 4/20 | 0.51 |
| ▸ | CDK2 | P24941 | 5/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.48 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.48 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL16655191 | 1.00 | CDK7 (0.70) | CDK7CCNHCCNT1CDK9MNAT1 | |
| SCHEMBL16665127 | 0.92 | CDK7 (0.70) | CDK7CCNHCCNT1CDK9MNAT1 | |
| SCHEMBL16665124 | 0.91 | CDK7 (0.67) | CDK7CCNHCCNT1CDK9MNAT1 | |
| SCHEMBL16654912 | 0.91 | CDK7 (0.83) | CDK7CCNHCCNT1CDK9MNAT1 | |
| SCHEMBL16654908 | 0.91 | CDK7 (0.83) | CDK7CCNHCCNT1CDK9MNAT1 | |
| SCHEMBL17688390 | 0.90 | CDK7 (0.82) | CDK7CCNHCCNT1CDK9MNAT1 | |
| SCHEMBL18047340 | 0.89 | CDK7 (0.65) | CDK7CCNHCCNT1CDK9MNAT1 | |
| SCHEMBL16665195 | 0.89 | CDK7 (0.65) | CDK7CCNHCCNT1CDK9MNAT1 | |
| Hydrochloric Acid SCHEMBL18047317 | 0.89 | CDK7 (0.81) | CDK7CCNHCCNT1CDK9MNAT1 | |
| SCHEMBL16665142 | 0.83 | CDK7 (0.83) | CDK7CCNHCCNT1CDK9MNAT1 |
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-3057956-A1 | POLYCYCLIC INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) | Dana-Farber Cancer Institute, Inc. (US) | 2016-08-24 | — | — | EP | disclosed |
| WO-2015058140-A1 | POLYCYCLIC INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2015-04-23 | — | — | WO | disclosed |