Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31013537 | 0.76 | ALDH1A1 (0.46) | ALDH1A1PKMNOTUM | |
| SCHEMBL28330130 | 0.73 | MIF (0.41) | MCHR1NOTUMPTGS1 | |
| SCHEMBL28523491 | 0.73 | ALDH1A1 (0.38) | CA2ALDH1A1PKMCYP11B1CYP11B2 | |
| SCHEMBL28102822 | 0.72 | HSP90AA1 (0.42) | ALDH1A1NOTUMPTGS1 | |
| SCHEMBL20097534 | 0.69 | MGLL (0.41) | MCHR1NOTUM | |
| SCHEMBL21609966 | 0.68 | NPBWR1 (0.36) | — | |
| SCHEMBL28150796 | 0.67 | AKR1B1 (0.51) | AKR1B1 | |
| SCHEMBL11937825 | 0.66 | KDM4E (0.59) | ALDH1A1 | |
| SCHEMBL9693899 | 0.66 | CES2 (0.42) | ALDH1A1 | |
| SCHEMBL13907255 | 0.66 | NR2E1 (0.41) | ALDH1A1PKMNR2E1NOTUM |
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-107739338-A | Formamide and urea derivative as capsaicin analog receptors ligand | 美迪福伦DBT有限公司 | 2018-02-27 | — | — | CN | disclosed |