Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX4 | Q99571 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SCN4A | P35499 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 14/20 | 0.34 |
| ▸ | SIRT3 | Q9NTG7 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | F7 | P08709 | 1/20 | 0.32 |
| ▸ | F3 | P13726 | 1/20 | 0.32 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.32 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.32 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.32 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.32 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Isoquinoline SCHEMBL28191779 | 0.81 | LMNA (0.40) | P2RX4LMNATSHRMAPK1SCN4A | |
| SCHEMBL1286806 | 0.77 | LMNA (0.55) | P2RX4LMNATSHRMAPK1SCN4A | |
| Hydrochloric Acid SCHEMBL28145471 | 0.76 | LMNA (0.53) | P2RX4LMNATSHRMAPK1SCN4A | |
| SCHEMBL5823517 | 0.73 | KDM4E (0.32) | P2RX4CYP11B2TDP1 | |
| SCHEMBL15083805 | 0.73 | P2RX4 (0.36) | P2RX4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL1836164 | 0.69 | PARP1 (0.36) | LMNATSHRMAPK1SCN4ASCN5A | |
| SCHEMBL30511570 | 0.69 | PARP1 (0.36) | LMNATSHRMAPK1SCN4ASCN5A | |
| SCHEMBL16671338 | 0.69 | PARP1 (0.36) | LMNATSHRMAPK1SCN4ASCN5A | |
| Isoquinoline SCHEMBL28075529 | 0.68 | P2RX4 (0.38) | P2RX4LMNATSHRMAPK1SCN4A | |
| SCHEMBL28778878 | 0.67 | LMNA (0.40) | P2RX4LMNATSHRMAPK1SCN4A |
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-2008001134-A1 | 1,2,3,8,9,9A-HEXAHYDRO-7H-BENZO(DE)-1,7-NAPHTHYRIDIN-7-ONE DERIVATIVES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2008-01-03 | — | — | WO | disclosed |