Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 2/20 | 0.50 |
| ▸ | WNT3A | P56704 | 2/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.48 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL733307 | 0.85 | CES2 (0.67) | CTNNB1WNT3ACES2CES1HPGD | |
| SCHEMBL11248287 | 0.74 | CES2 (0.69) | CES2CES1HPGDHDAC3HDAC4 | |
| SCHEMBL30758862 | 0.74 | CES2 (0.69) | CES2CES1HPGDHDAC3HDAC4 | |
| SCHEMBL28228418 | 0.73 | MTNR1B (0.68) | HPGDNPC1RAB9ASMN1; SMN2POLB | |
| SCHEMBL4637827 | 0.73 | CES2 (0.62) | CTNNB1WNT3ACES2CES1HPGD | |
| SCHEMBL1305114 | 0.73 | CES2 (0.67) | CTNNB1WNT3ACES2CES1HDAC3 | |
| SCHEMBL29588852 | 0.73 | CES2 (0.67) | CTNNB1WNT3ACES2CES1HDAC3 | |
| SCHEMBL25736079 | 0.73 | ERCC5 (0.49) | CES2CES1HDAC3HDAC4HDAC1 | |
| SCHEMBL10799135 | 0.72 | KMT2A (0.51) | CES2CES1HPGDNPC1RAB9A | |
| SCHEMBL21747300 | 0.72 | CTNNB1 (0.58) | CTNNB1WNT3ACES2CES1HPGD |
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-112759510-A | Preparation method of methoxamine hydrochloride degradation impurities | 广东嘉博制药有限公司 | 2021-05-07 | — | — | CN | disclosed |