Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 2/20 | 0.41 |
| ▸ | CDK9 | P50750 | 2/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | SMPD3 | Q9NY59 | 2/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
| ▸ | CDK4 | P11802 | 1/20 | 0.30 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.30 |
| ▸ | CCND1 | P24385 | 1/20 | 0.30 |
| ▸ | CCNC | P24863 | 1/20 | 0.30 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
| ▸ | CDK8 | P49336 | 1/20 | 0.30 |
| ▸ | CDK7 | P50613 | 1/20 | 0.30 |
| ▸ | CCNH | P51946 | 1/20 | 0.30 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.30 |
| ▸ | CDK3 | Q00526 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24418626 | 0.71 | CCNT1 (0.54) | CCNT1CDK9PDE2ACDK1CDK4 | |
| SCHEMBL24418567 | 0.70 | CCNT1 (0.56) | CCNT1CDK9CDK1CDK4CCNA2 | |
| SCHEMBL31441660 | 0.69 | CHRNA7 (0.35) | PIM1SMPD3IRAK4CHRNA7HTR3A | |
| SCHEMBL13500742 | 0.69 | ALDH1A1 (0.39) | IRAK4PDE2A | |
| SCHEMBL31069505 | 0.69 | DYRK1A (0.41) | CCNT1CDK9IRAK4CDK1CDK4 | |
| SCHEMBL23777305 | 0.69 | CCNT1 (0.30) | CCNT1CDK9CDK1CDK4CCNA2 | |
| SCHEMBL24422759 | 0.67 | SMPD3 (0.34) | CCNT1CDK9SMPD3IRAK4PDE2A | |
| SCHEMBL31465374 | 0.64 | ACVR2A (0.36) | — | |
| SCHEMBL29339727 | 0.62 | SMPD3 (0.57) | PIM1SMPD3 | |
| SCHEMBL17132579 | 0.62 | SMPD3 (0.38) | SMPD3IRAK4PDE2A |
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-4240422-A1 | COMPOUNDS AND METHODS FOR MODULATING CDK9 ACTIVITY | Kronos Bio, Inc. (US) | 2023-09-13 | — | — | EP | disclosed |
| WO-2022098843-A1 | COMPOUNDS AND METHODS FOR MODULATING CDK9 ACTIVITY | Kronos Bio, Inc. (US) | 2022-05-12 | — | — | WO | disclosed |