Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPI | P09923 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | XIAP | P98170 | 1/20 | 0.53 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CTRB1 | P17538 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ALPL | P05186 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALPG | P10696 | 1/20 | 0.47 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.46 |
| ▸ | CPA1 | P15085 | 2/20 | 0.46 |
| ▸ | CPA3 | P15088 | 2/20 | 0.46 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL246475 | 0.83 | CYP1A2 (0.61) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL28090728 | 0.83 | CYP1A2 (0.56) | ALPIPKMPTGS1XIAPSLC7A5 | |
| Ammonia Solution, Strong SCHEMBL38660546 | 0.81 | CYP1A2 (0.59) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL6964952 | 0.81 | CYP1A2 (0.54) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL7279699 | 0.80 | ATM (0.54) | CYP1A2CTRB1NPC1RAB9APOLB | |
| SCHEMBL12271851 | 0.79 | CYP1A2 (0.57) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL29020043 | 0.79 | EPHX1 (0.58) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL7810193 | 0.79 | CYP1A2 (0.52) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL11097150 | 0.79 | NPC1 (0.49) | CYP1A2CTRB1NPC1RAB9A | |
| SCHEMBL497369 | 0.78 | CYP1A2 (0.68) | ALPIPKMPTGS1XIAPSLC7A5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112321398-B | Method for synthesizing alpha-fluorinated ketone by hydrazonating aliphatic chain monoketone | 中山大学 | 2021-11-23 | — | — | CN | disclosed |
| CN-112321398-A | Method for synthesizing alpha-fluorinated ketone by hydrazonating aliphatic chain monoketone | 中山大学 | 2021-02-05 | — | — | CN | disclosed |