Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 9/20 | 0.72 |
| ▸ | CCNT1 | O60563 | 6/20 | 0.72 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.72 |
| ▸ | CDK1 | P06493 | 2/20 | 0.72 |
| ▸ | CDK4 | P11802 | 2/20 | 0.72 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.72 |
| ▸ | CCND1 | P24385 | 2/20 | 0.72 |
| ▸ | ABL2 | P42684 | 2/20 | 0.72 |
| ▸ | GSK3A | P49840 | 2/20 | 0.72 |
| ▸ | CDK7 | P50613 | 2/20 | 0.72 |
| ▸ | CCNH | P51946 | 2/20 | 0.72 |
| ▸ | MNAT1 | P51948 | 2/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.64 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 2/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL8514873 | 0.86 | CDK9 (0.72) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL8515082 | 0.86 | CDK9 (0.72) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL8515998 | 0.85 | CDK9 (0.71) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL2026511 | 0.84 | CDK9 (0.54) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL8514643 | 0.83 | CDK9 (0.69) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL8516577 | 0.83 | CYP1A2 (0.86) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL8516573 | 0.82 | CYP1A2 (0.69) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL8515811 | 0.82 | CDK9 (0.80) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL8515971 | 0.81 | CDK9 (0.79) | CDK9CCNT1MAP4K4CDK1CDK4 | |
| SCHEMBL8513621 | 0.81 | CYP1A2 (0.74) | CDK9CCNT1MAP4K4CDK1CDK4 |
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-2137166-B1 | 4, 6-DISUBSTITUTED AMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES | INGENIUM PHARMACEUTICALS GMBH (DE) | 2012-05-30 | — | — | EP | claimed |