Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | IAPP | P10997 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25457423 | 0.79 | ALDH1A1 (0.45) | ALDH1A1MEN1TSHRKMT2AHTT | |
| SCHEMBL21154361 | 0.76 | MPO (0.46) | ALDH1A1MEN1TSHRKMT2ALMNA | |
| SCHEMBL27946009 | 0.75 | AOC3 (0.54) | ALOX5ALDH1A1MEN1TSHRKMT2A | |
| SCHEMBL7813393 | 0.73 | POLB (0.51) | POLB | |
| SCHEMBL578043 | 0.73 | ALDH1A1 (0.41) | ALDH1A1MEN1TSHRKMT2AHTT | |
| SCHEMBL28453244 | 0.73 | PPARA (0.44) | ALOX5TSHROR51E2L3MBTL1IAPP | |
| SCHEMBL3891871 | 0.72 | PDE4D (0.44) | ALDH1A1MEN1TSHRKMT2ALMNA | |
| SCHEMBL28608030 | 0.71 | TAAR1 (0.46) | ALDH1A1MEN1TSHRKMT2ALMNA | |
| SCHEMBL28919441 | 0.71 | IAPP (0.50) | ALOX5ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL23655259 | 0.71 | ALDH1A1 (0.39) | ALOX5ALDH1A1OR51E2IAPPTAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103030636-A | Macrocyclic inhibitors of hepatitis c virus | MEDIVIR AB | 2013-04-10 | — | — | CN | disclosed |