Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | P2RX3 | P56373 | 9/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3851147 | 0.91 | NPC1 (0.45) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL3855261 | 0.91 | NPC1 (0.52) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL3580638 | 0.84 | NPC1 (0.46) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL3854496 | 0.77 | MAPT (0.42) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL3581650 | 0.76 | NPC1 (0.44) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL14945869 | 0.75 | NPC1 (0.48) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL3578024 | 0.74 | NPC1 (0.50) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL3582065 | 0.72 | NPC1 (0.47) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL3584604 | 0.71 | NPC1 (0.48) | NPC1SMN1; SMN2LMNARAB9AGAA | |
| SCHEMBL3578648 | 0.70 | NPC1 (0.48) | NPC1SMN1; SMN2LMNARAB9AGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2104670-A2 | NOVEL TRIAZINEDIONE DERIVATIVES AS GABA-B RECEPTOR MODULATORS | Addex Pharma SA (CH) | 2009-09-30 | — | — | EP | disclosed |
| WO-2008056257-A2 | NOVEL TRIAZINEDIONE DERIVATIVES AS GABA-B RECEPTOR MODULATORS | ADDEX PHARMA S.A (CH) | 2008-05-15 | — | — | WO | disclosed |