Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11186332 | 1.00 | NPSR1 (0.45) | NPSR1CYP1A2CYP2C19USP2EPHX1 | |
| SCHEMBL11187447 | 0.87 | USP2 (0.44) | NPSR1CYP1A2CYP2C19USP2POLB | |
| SCHEMBL11187443 | 0.87 | USP2 (0.44) | NPSR1CYP1A2CYP2C19USP2POLB | |
| SCHEMBL11183921 | 0.86 | RAB9A (0.48) | CYP1A2ALDH1A1POLBNPC1RAB9A | |
| SCHEMBL11183917 | 0.86 | RAB9A (0.48) | CYP1A2ALDH1A1POLBNPC1RAB9A | |
| SCHEMBL11185654 | 0.84 | RAB9A (0.54) | NPSR1CYP1A2CYP2C19EPHX1NPC1 | |
| SCHEMBL11185667 | 0.84 | RAB9A (0.54) | NPSR1CYP1A2CYP2C19EPHX1NPC1 | |
| SCHEMBL11187459 | 0.80 | RAB9A (0.63) | NPSR1CYP1A2CYP2C19ALDH1A1NPC1 | |
| SCHEMBL11187460 | 0.80 | RAB9A (0.63) | NPSR1CYP1A2CYP2C19ALDH1A1NPC1 | |
| Hydrochloric Acid SCHEMBL11185071 | 0.79 | CYP1A2 (0.48) | NPSR1CYP1A2CYP2C19USP2EPHX1 |
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-4407816-A | ANTIULCER | KOTOBUKI SEIYAKU COMPANY LIMITED (JP) | 1983-10-04 | — | — | US | disclosed |