Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 3/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.31 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 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 | |
|---|---|---|---|---|
| SCHEMBL9860029 | 0.89 | HTR2A (0.32) | CYP2D6CYP3A4LMNAKDM4ETP53 | |
| SCHEMBL4004558 | 0.85 | HTR2A (0.34) | HTR2A | |
| SCHEMBL815618 | 0.82 | BCHE (0.35) | BCHEACHECYP2D6CYP3A4CYP2C9 | |
| SCHEMBL5859366 | 0.81 | CYP11B1 (0.33) | CYP2D6CYP3A4LMNAKDM4ETP53 | |
| Fluoride Ion SCHEMBL1131501 | 0.81 | BCHE (0.34) | BCHEACHECYP2D6CYP3A4CYP2C9 | |
| SCHEMBL10644406 | 0.81 | TSHR (0.36) | BCHEACHECYP2D6CYP3A4CYP2C9 | |
| SCHEMBL6056009 | 0.81 | BCHE (0.34) | BCHEACHECYP2D6CYP3A4CYP2C9 | |
| SCHEMBL18242642 | 0.81 | CYP3A4 (0.36) | BCHEACHECYP2D6CYP3A4CYP2C9 | |
| SCHEMBL11590486 | 0.81 | BCHE (0.34) | BCHEACHECYP2D6CYP3A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL813274 | 0.81 | BCHE (0.34) | BCHEACHECYP2D6CYP3A4CYP2C9 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119080847-A | Tetrahydronaphthol-phosphorus monocyclochrome metal complex and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-12-06 | — | — | CN | claimed |
| CN-118620004-A | Phosphine-phenol chromocene metal organic complex, preparation method and application thereof | 中国石油化工股份有限公司 | 2024-09-10 | — | — | CN | claimed |
| CN-117903217-A | Phosphine-phenol single-chromocene metal complex, preparation method and application thereof | 中国石油化工股份有限公司 | 2024-04-19 | — | — | CN | claimed |
| CN-119080847-A | Tetrahydronaphthol-phosphorus monocyclochrome metal complex and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-12-06 | — | — | CN | disclosed |
| CN-118620004-A | Phosphine-phenol chromocene metal organic complex, preparation method and application thereof | 中国石油化工股份有限公司 | 2024-09-10 | — | — | CN | disclosed |
| CN-117903217-A | Phosphine-phenol single-chromocene metal complex, preparation method and application thereof | 中国石油化工股份有限公司 | 2024-04-19 | — | — | CN | disclosed |