Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.41 |
| ▸ | TSHR | P16473 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.38 |
| ▸ | CASP1 | P29466 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.38 |
| ▸ | PDE4A | P27815 | 2/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11160237 | 0.82 | TSHR (0.41) | ALDH1A1TSHRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL11155724 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TSHRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL11166828 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TSHRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10801776 | 0.75 | TSHR (0.52) | ALDH1A1TSHRLMNAMAPK1HSD17B10 | |
| SCHEMBL10912433 | 0.72 | HPGD (0.47) | ALDH1A1TSHRKDM4EUSP2LMNA | |
| SCHEMBL11152620 | 0.69 | CNOT7 (0.44) | ALDH1A1PLA2G7HSD17B10MAPT | |
| SCHEMBL2116411 | 0.69 | HSD17B10 (0.34) | ALDH1A1TSHRKDM4ELMNAHSD17B10 | |
| SCHEMBL17870793 | 0.67 | CMA1 (0.47) | TSHRKDM4ELMNAMAPTTP53 | |
| SCHEMBL25419023 | 0.66 | HSD17B10 (0.36) | ALDH1A1TSHRKDM4ELMNAPDE4A | |
| SCHEMBL11167293 | 0.66 | CYP3A4 (0.38) | ALDH1A1KDM4ECYP1A2CYP3A4CASP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0032131-B1 | 5-HALO-PYRIMIDIN-2-ONES, THE SALTS THEREOF, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | NYEGAARD & CO. A/S (NO) | 1983-09-21 | — | — | EP | claimed |
| EP-0032131-B1 | 5-HALO-PYRIMIDIN-2-ONES, THE SALTS THEREOF, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | NYEGAARD & CO. A/S (NO) | 1983-09-21 | — | — | EP | disclosed |
| US-4399140-A | CYTOTOXIC | NYEGAARD & CO. A/S (NO) | 1983-08-16 | — | — | US | disclosed |