Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.43 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | MET | P08581 | 1/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31147615 | 1.00 | BRD4 (0.43) | BRD4PSIP1GLO1PTGS1PTGS2 | |
| SCHEMBL30942594 | 0.91 | BRD4 (0.45) | BRD4GLO1PTGS1PTGS2EGFR | |
| SCHEMBL27237987 | 0.91 | BRD4 (0.45) | BRD4GLO1PTGS1PTGS2EGFR | |
| SCHEMBL602490 | 0.88 | ALK (0.46) | PSIP1GLO1EGFRCDK7CDK9 | |
| SCHEMBL38655775 | 0.88 | ALK (0.46) | PSIP1GLO1EGFRCDK7CDK9 | |
| SCHEMBL31147654 | 0.88 | ALK (0.46) | PSIP1GLO1EGFRCDK7CDK9 | |
| SCHEMBL30942610 | 0.87 | GLO1 (0.52) | GLO1PTGS1PTGS2EGFRMET | |
| SCHEMBL1076995 | 0.87 | GLO1 (0.52) | GLO1PTGS1PTGS2EGFRMET | |
| SCHEMBL10074538 | 0.86 | GLO1 (0.55) | PSIP1GLO1AURKAALKALDH1A1 | |
| SCHEMBL38657160 | 0.86 | MEN1 (0.48) | PSIP1GLO1EGFRCDK7CDK9 |
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-4382514-A1 | PYRIMIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT | Korea Research Institute of Chemical Technology (KR) | 2024-06-12 | — | — | EP | disclosed |
| WO-2023014022-A1 | PYRIMIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT | 한국화학연구원 | 2023-02-09 | — | — | WO | disclosed |