Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 4/20 | 0.52 |
| ▸ | BCR | P11274 | 3/20 | 0.52 |
| ▸ | SRC | P12931 | 3/20 | 0.52 |
| ▸ | CDK2 | P24941 | 2/20 | 0.52 |
| ▸ | CDK4 | P11802 | 1/20 | 0.52 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | PRKACA | P17612 | 1/20 | 0.50 |
| ▸ | PRKACG | P22612 | 1/20 | 0.50 |
| ▸ | PRKACB | P22694 | 1/20 | 0.50 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3609491 | 0.88 | CAMK2D (0.53) | ABL1BCRCDK2CDK4CDK5 | |
| SCHEMBL3602192 | 0.80 | CAMK2D (0.58) | ABL1BCRCDK2CDK4CDK5 | |
| SCHEMBL3609046 | 0.76 | CDK1 (0.65) | ABL1BCRCDK2CDK4CDK5 | |
| SCHEMBL3608406 | 0.75 | CAMK2D (0.53) | ABL1BCRCDK2CDK4CDK5 | |
| SCHEMBL3597064 | 0.75 | PIK3CA (0.52) | ABL1BCRCDK2CDK4CDK5 | |
| SCHEMBL3610719 | 0.74 | CAMK2D (0.54) | ABL1BCRCDK2CDK4CDK5 | |
| SCHEMBL14140367 | 0.74 | ABL1 (0.48) | ABL1BCRSRCCDK2CDK4 | |
| SCHEMBL14140481 | 0.73 | CAMK2D (0.49) | ABL1BCRCDK2CDK4CDK5 | |
| SCHEMBL14140620 | 0.73 | ABL1 (0.50) | ABL1BCRSRCCDK2CDK4 | |
| SCHEMBL3607290 | 0.73 | ABL1 (0.43) | ABL1BCRSRCCDK2EGFR |
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-2008079933-A2 | HETEROARYL-HETEROARYL COMPOUNDS AS CDK INHIBITORS FOR THE TREATMENT OF CANCER, INFLAMMATION AND VIRAL INFECTIONS | NOVARTIS AG (CH) | 2008-07-03 | — | — | WO | disclosed |