Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9524767 | 0.89 | LMNA (0.53) | NPC1RAB9ALMNAPOLBSMN1; SMN2 | |
| Iodide SCHEMBL9525321 | 0.84 | HTR1B (0.41) | NPC1RAB9ALMNAALDH1A1HTR1D | |
| Iodide SCHEMBL9526359 | 0.83 | HTR1B (0.40) | NPC1LMNAALDH1A1HTR1DHTR1B | |
| SCHEMBL9528248 | 0.82 | LMNA (0.62) | NPC1RAB9ALMNAPOLBSMN1; SMN2 | |
| SCHEMBL9526235 | 0.82 | LMNA (0.49) | NPC1RAB9ALMNAPOLBSMN1; SMN2 | |
| Iodide SCHEMBL9525497 | 0.74 | HPGD (0.41) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| Iodide SCHEMBL9526181 | 0.74 | HTR1B (0.43) | NPC1LMNAALDH1A1CYP2C9HTT | |
| SCHEMBL9526144 | 0.73 | ALDH1A1 (0.39) | LMNAPOLBSMN1; SMN2ALDH1A1NPSR1 | |
| Iodide SCHEMBL9525064 | 0.73 | HTR1B (0.42) | NPC1LMNAALDH1A1CYP2C9HTT | |
| Iodide SCHEMBL9525155 | 0.72 | HPGD (0.44) | NPC1LMNAALDH1A1HTR1DHTR1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0301751-B1 | PYRIDINIUM DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |
| US-4962113-A | PLATELET ACTIVATING FACTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD (JP) | 1990-10-09 | — | — | US | disclosed |
| EP-0301751-A1 | Pyridinium derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1989-02-01 | — | — | EP | disclosed |