Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 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 | |
|---|---|---|---|---|
| SCHEMBL9961813 | 0.90 | POLB (0.45) | POLBLMNADRD2DRD4DRD3 | |
| Hydrochloric Acid SCHEMBL3319188 | 0.89 | POLB (0.44) | POLBLMNADRD2DRD4DRD3 | |
| SCHEMBL9961831 | 0.88 | POLB (0.42) | POLBLMNADRD2DRD4DRD3 | |
| SCHEMBL9961650 | 0.88 | KDM4E (0.46) | POLBLMNADRD2DRD4DRD3 | |
| Hydrochloric Acid SCHEMBL3325235 | 0.87 | POLB (0.41) | POLBLMNADRD2DRD4DRD3 | |
| SCHEMBL9961827 | 0.87 | POLB (0.40) | POLBLMNADRD2DRD4DRD3 | |
| Hydrochloric Acid SCHEMBL3319466 | 0.87 | KDM4E (0.45) | POLBLMNADRD2DRD4DRD3 | |
| Hydrochloric Acid SCHEMBL3319810 | 0.86 | POLB (0.39) | POLBLMNADRD2DRD4DRD3 | |
| SCHEMBL9961826 | 0.84 | POLB (0.38) | POLBLMNADRD2DRD4DRD3 | |
| SCHEMBL9961829 | 0.84 | KMT2A (0.41) | POLBLMNAKMT2AALDH1A1MEN1 |
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-2008141020-A1 | 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2008-11-20 | — | — | WO | disclosed |