Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL8499170 | 1.00 | CES2 (0.40) | CES2CES1CYP11B1CYP11B2CYP1A2 | |
| SCHEMBL8499194 | 0.79 | KDM4E (0.47) | CES2CES1ALDH1A1ATMLMNA | |
| SCHEMBL8495608 | 0.79 | ATM (0.59) | CES2CES1NPSR1ALDH1A1ATM | |
| SCHEMBL8495612 | 0.79 | ATM (0.59) | CES2CES1NPSR1ALDH1A1ATM | |
| SCHEMBL8499190 | 0.79 | KDM4E (0.47) | CES2CES1ALDH1A1ATMLMNA | |
| SCHEMBL8498706 | 0.77 | ATM (0.44) | CES2CES1ALDH1A1ATMLMNA | |
| SCHEMBL8498707 | 0.77 | ATM (0.44) | CES2CES1ALDH1A1ATMLMNA | |
| SCHEMBL8496724 | 0.74 | MEN1 (0.50) | CYP1A2CYP3A4CYP2C9CYP2C19NPSR1 | |
| SCHEMBL8496723 | 0.74 | MEN1 (0.50) | CYP1A2CYP3A4CYP2C9CYP2C19NPSR1 | |
| SCHEMBL8493502 | 0.71 | ATM (0.57) | CES2CES1ALDH1A1ATMLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999040062-A1 | HYDRAZONE DERIVATIVES | NOVO NORDISK A/S (DK) | 1999-08-12 | — | — | WO | claimed |