Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 20/20 | 0.66 |
| ▸ | CCNT1 | O60563 | 19/20 | 0.66 |
| ▸ | CDK4 | P11802 | 7/20 | 0.66 |
| ▸ | CCND1 | P24385 | 7/20 | 0.66 |
| ▸ | CDK7 | P50613 | 5/20 | 0.66 |
| ▸ | CDK2 | P24941 | 5/20 | 0.66 |
| ▸ | CCNH | P51946 | 4/20 | 0.66 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.66 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.66 |
| ▸ | CDK3 | Q00526 | 4/20 | 0.66 |
| ▸ | CDK1 | P06493 | 3/20 | 0.66 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.66 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.66 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.66 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.66 |
| ▸ | CDK13 | Q14004 | 2/20 | 0.66 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.66 |
| ▸ | CCNK | O75909 | 1/20 | 0.66 |
| ▸ | CDK14 | O94921 | 1/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL24418930 | 1.00 | CDK9 (0.66) | CDK9CCNT1CDK4CCND1CDK7 | |
| Hydrochloric Acid SCHEMBL29558414 | 0.99 | CDK9 (0.65) | CDK9CCNT1CDK4CCND1CDK7 | |
| SCHEMBL24418845 | 0.88 | CDK9 (0.59) | CDK9CCNT1CDK4CCND1CDK7 | |
| SCHEMBL24418931 | 0.88 | CDK9 (0.59) | CDK9CCNT1CDK4CCND1CDK7 | |
| SCHEMBL24418928 | 0.85 | CCNT1 (0.56) | CDK9CCNT1CDK4CCND1CDK7 | |
| SCHEMBL24418932 | 0.85 | CCNT1 (0.56) | CDK9CCNT1CDK4CCND1CDK7 | |
| SCHEMBL24418611 | 0.81 | CCNT1 (0.78) | CDK9CCNT1CDK4CCND1CDK7 | |
| SCHEMBL29558215 | 0.81 | CCNT1 (0.71) | CDK9CCNT1CDK4CCND1CDK7 | |
| Istisociclib SCHEMBL21877722 | 0.80 | CDK9 (1.00) | CDK9CCNT1CDK4CCND1CDK7 | |
| Istisociclib SCHEMBL30467857 | 0.80 | CDK9 (1.00) | CDK9CCNT1CDK4CCND1CDK7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022098843-A1 | COMPOUNDS AND METHODS FOR MODULATING CDK9 ACTIVITY | Kronos Bio, Inc. (US) | 2022-05-12 | — | — | WO | disclosed |