Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL4322455 | 0.80 | TAAR1 (0.42) | CYP2C19L3MBTL1HPGDPOLBRAB9A | |
| SCHEMBL4655199 | 0.77 | ADRA2A (0.47) | CYP2C19L3MBTL1HPGDPOLBRAB9A | |
| SCHEMBL9689911 | 0.74 | CYP2C19 (0.44) | CYP2C19L3MBTL1HPGDPOLBTDP1 | |
| SCHEMBL9689903 | 0.74 | CYP2C19 (0.44) | CYP2C19L3MBTL1HPGDPOLBTDP1 | |
| Acetic Acid SCHEMBL11332370 | 0.74 | CYP2C19 (0.57) | CYP2C19L3MBTL1HPGDPOLBTDP1 | |
| SCHEMBL11420392 | 0.72 | TAAR1 (0.42) | CYP2C19L3MBTL1HPGDPOLBTDP1 | |
| Acetic Acid SCHEMBL6386413 | 0.72 | CYP2C19 (0.55) | CYP2C19L3MBTL1HPGDPOLBTDP1 | |
| SCHEMBL30528 | 0.72 | CYP2C9 (0.51) | HPGDLMNARAB9ANPC1ALDH1A1 | |
| SCHEMBL5715779 | 0.72 | TAAR1 (0.42) | CYP2C19L3MBTL1HPGDPOLBTDP1 | |
| SCHEMBL30530 | 0.72 | CYP2C9 (0.51) | HPGDLMNARAB9ANPC1ALDH1A1 |
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-113548988-A | Fluorine-containing photoacid generator, and preparation method and application thereof | 安徽庆润新材料技术有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-109456243-B | (Z) - β -selenocyanate acrylate compound and preparation method thereof | 湖南科技学院 | 2020-08-04 | — | — | CN | disclosed |