Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 20/20 | 0.74 |
| ▸ | CCNT1 | O60563 | 14/20 | 0.74 |
| ▸ | CASP3 | P42574 | 8/20 | 0.63 |
| ▸ | CASP7 | P55210 | 8/20 | 0.63 |
| ▸ | CDK1 | P06493 | 2/20 | 0.57 |
| ▸ | CDK2 | P24941 | 2/20 | 0.57 |
| ▸ | GSK3B | P49841 | 2/20 | 0.57 |
| ▸ | CDK7 | P50613 | 2/20 | 0.57 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL16050996 | 0.92 | CCNT1 (0.74) | CDK9CCNT1 | |
| SCHEMBL16051700 | 0.85 | CDK9 (0.73) | CDK9CCNT1CASP3CASP7CDK1 | |
| SCHEMBL16040358 | 0.85 | CDK9 (1.00) | CDK9CCNT1CASP3CASP7CDK1 | |
| SCHEMBL16042926 | 0.85 | CDK9 (0.66) | CDK9CCNT1CASP3CASP7CDK1 | |
| SCHEMBL16050566 | 0.84 | CCNT1 (0.80) | CDK9CCNT1CASP3CASP7 | |
| SCHEMBL16052771 | 0.83 | CCNT1 (0.80) | CDK9CCNT1 | |
| SCHEMBL16052262 | 0.82 | CDK9 (0.74) | CDK9CCNT1CASP3CASP7 | |
| SCHEMBL16051201 | 0.82 | CDK9 (0.73) | CDK9CCNT1CASP3CASP7 | |
| SCHEMBL16041083 | 0.78 | CDK9 (0.70) | CDK9CCNT1CASP3CASP7CDK12 | |
| SCHEMBL16041546 | 0.77 | CDK9 (1.00) | CDK9CCNT1CASP3CASP7CDK1 |
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-2970278-A1 | PYRROLO[2,3-B]PYRIDINE CDK9 KINASE INHIBITORS | AbbVie Inc. (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014139328-A1 | PYRROLO[2,3-B]PYRIDINE CDK9 KINASE INHIBITORS | ABBVIE INC. (US) | 2014-09-18 | — | — | WO | disclosed |