Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | DHODH | Q02127 | 2/20 | 0.36 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.35 |
| ▸ | CACNG8 | Q8WXS5 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 4/20 | 0.34 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23782219 | 1.00 | DRD2 (0.37) | DRD2DRD4DRD3POLBNPSR1 | |
| SCHEMBL23782187 | 0.80 | ALDH1A1 (0.50) | HPGDPARP1 | |
| SCHEMBL17276057 | 0.77 | NUDT1 (0.44) | DRD2DRD4DRD3POLBNPSR1 | |
| SCHEMBL23800777 | 0.77 | PARP1 (0.42) | POLBKDM4EHPGDMEN1GAA | |
| SCHEMBL9674862 | 0.77 | MEN1 (0.58) | DRD2DRD4DRD3POLBNPSR1 | |
| SCHEMBL2767156 | 0.74 | EGLN1 (0.42) | DHODHGAAL3MBTL1PARP1 | |
| SCHEMBL23782284 | 0.73 | GNRHR (0.36) | DRD2DRD4DRD3POLBKDM4E | |
| Hydrochloric Acid SCHEMBL25221123 | 0.73 | EGLN1 (0.41) | POLBDHODHMEN1GAAMAPT | |
| SCHEMBL23782282 | 0.72 | KDM4E (0.34) | POLBKDM4EHPGDMEN1GAA | |
| SCHEMBL23782273 | 0.71 | CYP2A6 (0.41) | KDM4EHPGDMEN1GAAMAPT |
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-4114837-A1 | PYRAZOLOPYRAZINES ACTING ON CANCERS VIA INHIBITION OF CDK12 | Bayer Aktiengesellschaft (DE) | 2023-01-11 | — | — | EP | disclosed |