Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL6780266 | 0.94 | CYP2C9 (0.44) | CYP2C9CYP2C19CYP2D6TP53NPC1 | |
| SCHEMBL6773797 | 0.83 | KMT2A (0.43) | CYP2C9CYP2C19CYP2D6MAPK1ALDH1A1 | |
| SCHEMBL6780099 | 0.83 | KMT2A (0.43) | CYP2C9CYP2C19TSHRALDH1A1CYP3A4 | |
| SCHEMBL6780037 | 0.80 | CYP3A4 (0.40) | CYP2C9CYP2C19CYP2D6TP53ALDH1A1 | |
| SCHEMBL6778982 | 0.80 | TLR7 (0.40) | CYP2C9CYP2C19CYP2D6TP53NPC1 | |
| SCHEMBL6778251 | 0.80 | MEN1 (0.43) | CYP2C9CYP2C19CYP2D6TP53TSHR | |
| SCHEMBL5031355 | 0.79 | TLR7 (0.40) | HTT | |
| SCHEMBL6777327 | 0.79 | TLR7 (0.34) | — | |
| SCHEMBL6778198 | 0.79 | CA1 (0.40) | CYP2C9CYP2C19CYP2D6ALDH1A1CYP3A4 | |
| SCHEMBL6780566 | 0.79 | CYP3A4 (0.45) | CYP2C9CYP2C19CYP2D6TP53ALDH1A1 |
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-6696465-B2 | INDUCING BIOSYNTHESIS OF CYTOKINES; VIRAL AND NEOPLASTIC DISEASES | 3M INNOVATIVE PROPERTIES COMPANY | 2004-02-24 | — | — | US | claimed |