Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UCHL1 | P09936 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 5/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL20157598 | 0.87 | MAPT (0.52) | UCHL1MAPTHTTNPSR1ALDH1A1 | |
| SCHEMBL18125724 | 0.86 | POLB (0.59) | UCHL1MAPTHTTNPSR1GAA | |
| SCHEMBL20157840 | 0.86 | HTT (0.48) | UCHL1MAPTHTTNPSR1GAA | |
| SCHEMBL29582110 | 0.86 | POLB (0.59) | UCHL1MAPTHTTNPSR1GAA | |
| SCHEMBL20157902 | 0.81 | CXCR2 (0.41) | UCHL1MAPTGAAALDH1A1LMNA | |
| SCHEMBL29853895 | 0.80 | KDM4E (0.49) | UCHL1MAPTHTTNPSR1GAA | |
| SCHEMBL19946115 | 0.80 | KDM4E (0.49) | UCHL1MAPTHTTNPSR1GAA | |
| SCHEMBL29272831 | 0.79 | SMN1; SMN2 (0.48) | UCHL1MAPTGAAALDH1A1NPC1 | |
| SCHEMBL20157806 | 0.77 | HTT (0.49) | UCHL1MAPTHTTNPSR1GAA | |
| SCHEMBL20157615 | 0.77 | UCHL1 (0.48) | UCHL1MAPTHTTNPSR1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3539960-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | Luoxin Pharmaceutical (Shanghai) Co., Ltd. (CN) | 2019-09-18 | — | — | EP | disclosed |