Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8089347 | 0.88 | MAPT (0.37) | MAPTSMN1; SMN2NPC1RAB9ALMNA | |
| Hydrochloric Acid SCHEMBL8089324 | 0.87 | MAPT (0.37) | MAPTSMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL8503006 | 0.85 | POLB (0.32) | POLB | |
| SCHEMBL8091121 | 0.83 | SMN1; SMN2 (0.38) | MAPTSMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL8089226 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL8092772 | 0.81 | NPC1 (0.42) | MAPTSMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL7850659 | 0.75 | CYP1A2 (0.50) | MAPTSMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL8092754 | 0.75 | CYP1A2 (0.49) | MAPTSMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL7848644 | 0.75 | CYP1A2 (0.49) | MAPTSMN1; SMN2NPC1RAB9ALMNA | |
| Hydrochloric Acid SCHEMBL8089221 | 0.75 | CYP1A2 (0.49) | MAPTSMN1; SMN2NPC1RAB9ALMNA |
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-6043242-A | TREATING A MAMMAL AFFLICTED WITH A DISEASE BASED ON HELICOBACTER BACTERIA | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 2000-03-28 | — | — | US | disclosed |