Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.37 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 3/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 3/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | HTR1B | P28222 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | PTPRZ1 | P23471 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL16559590 | 0.90 | NFE2L2 (0.40) | CA1CA2CXCR2CXCR1CA9 | |
| SCHEMBL22444656 | 0.88 | SLC22A12 (0.43) | CA1CA2CXCR2CXCR1MAPT | |
| SCHEMBL30832531 | 0.84 | CXCR2 (0.36) | CA1CA2CXCR2PDE4APDE4C | |
| SCHEMBL6852624 | 0.83 | CA1 (0.40) | CA1CA2CXCR2CXCR1HTR1D | |
| SCHEMBL1017950 | 0.82 | PDE4A (0.42) | CA1CA2PDE4APDE4CPDE4D | |
| SCHEMBL16548489 | 0.82 | KDM4E (0.40) | PDE4APDE4CPDE4DL3MBTL1MAPT | |
| SCHEMBL3574836 | 0.82 | ALDH1A1 (0.38) | CA1CA2PDE4APDE4CPDE4D | |
| SCHEMBL752015 | 0.80 | CXCR2 (0.39) | CA1CA2CXCR2CXCR1HTR1D | |
| SCHEMBL1018963 | 0.80 | PDE4A (0.41) | CA1CA2PDE4APDE4CPDE4D | |
| SCHEMBL8178203 | 0.80 | L3MBTL1 (0.60) | L3MBTL1MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6262268-B1 | REACTING 2,5-DI(3-PROPYLAMINO)PYRIDINE WITH BASE IN SOLVENT TO FORM 3-(5,6,7,8-TETRAHYDRO-(1,8)-NAPHTHYRIDIN-2-YL)-PROPYLAMINE AND ISOLATING PRODUCT | MERCK & CO., INC. | 2001-07-17 | — | — | US | disclosed |