Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 10/20 | 0.69 |
| ▸ | MTOR | P42345 | 8/20 | 0.69 |
| ▸ | SMG1 | Q96Q15 | 7/20 | 0.69 |
| ▸ | ABL1 | P00519 | 2/20 | 0.67 |
| ▸ | BCR | P11274 | 2/20 | 0.67 |
| ▸ | SRC | P12931 | 1/20 | 0.67 |
| ▸ | CDK2 | P24941 | 8/20 | 0.67 |
| ▸ | IKBKB | O14920 | 4/20 | 0.66 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.66 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.66 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.64 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.64 |
| ▸ | CDK9 | P50750 | 3/20 | 0.64 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.64 |
| ▸ | CDK7 | P50613 | 2/20 | 0.64 |
| ▸ | CCNH | P51946 | 2/20 | 0.64 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.64 |
| ▸ | PRKCA | P17252 | 1/20 | 0.61 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.60 |
| ▸ | SYK | P43405 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL7471938 | 0.89 | ABL1 (0.70) | CDK1MTORSMG1ABL1BCR | |
| SCHEMBL3518683 | 0.87 | IKBKB (0.66) | CDK1MTORSMG1ABL1CDK2 | |
| SCHEMBL6752979 | 0.86 | CAMK2D (0.67) | CDK1MTORSMG1ABL1BCR | |
| SCHEMBL7464681 | 0.83 | CDK1 (0.61) | CDK1MTORSMG1ABL1BCR | |
| SCHEMBL6752978 | 0.83 | CDK1 (0.66) | CDK1MTORSMG1ABL1BCR | |
| SCHEMBL6667467 | 0.82 | ABL1 (0.60) | CDK1MTORSMG1ABL1BCR | |
| SCHEMBL3521890 | 0.82 | CDK1 (0.62) | CDK1MTORSMG1CDK2IKBKB | |
| SCHEMBL1667404 | 0.82 | IKBKB (0.62) | CDK1MTORSMG1CDK2IKBKB | |
| SCHEMBL3520990 | 0.81 | CDK1 (0.66) | CDK1MTORSMG1CDK2IKBKB | |
| SCHEMBL1789 | 0.81 | ABL1 (1.00) | ABL1BCRSRCCDK2PIK3CA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0233461-B2 | 4,5,6-Substituted-2-pyrimidinamines | AMERICAN CYANAMID CO (US) | 2002-05-29 | — | — | EP | disclosed |