Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 4/20 | 0.34 |
| ▸ | PIM1 | P11309 | 4/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.34 |
| ▸ | CDK2 | P24941 | 3/20 | 0.34 |
| ▸ | CSNK2A1 | P68400 | 3/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | USP14 | P54578 | 1/20 | 0.32 |
| ▸ | REN | P00797 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL1667677 | 1.00 | NTRK1 (0.34) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL1667729 | 0.88 | NTRK1 (0.33) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL1667731 | 0.88 | NTRK1 (0.33) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL1667736 | 0.88 | NTRK1 (0.33) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL1667776 | 0.81 | NTRK1 (0.37) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL1667774 | 0.81 | NTRK1 (0.37) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL1667678 | 0.80 | FEN1 (0.33) | HSP90AA1HSP90AB1FEN1USP14PPARG | |
| SCHEMBL1667700 | 0.76 | BRD4 (0.36) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL1667699 | 0.76 | BRD4 (0.36) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL1667882 | 0.75 | NTRK1 (0.33) | NTRK1PIM1CHEK1CDK2CSNK2A1 |
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-2011042474-A1 | NOVEL ESTROGEN RECEPTOR LIGANDS | KARO BIO AB (SE) | 2011-04-14 | — | — | WO | claimed |