Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Lithium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | OXTR | P30559 | 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 | |
|---|---|---|---|---|
| SCHEMBL28892013 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL28891930 | 0.68 | ALDH1A1 (0.31) | KMT2ACYP3A4MEN1 | |
| SCHEMBL7997573 | 0.65 | OPRM1 (0.33) | — | |
| SCHEMBL14232376 | 0.63 | CCKAR (0.39) | KIF11OXTR | |
| SCHEMBL6055589 | 0.62 | THRB (0.41) | KIF11 | |
| Oxalic Acid SCHEMBL27277403 | 0.62 | KDM4E (0.36) | KIF11OXTR | |
| Lithium Ion SCHEMBL28451039 | 0.61 | CYP2D6 (0.57) | KMT2ALMNACYP2D6MEN1 | |
| SCHEMBL28032107 | 0.61 | THRB (0.44) | KIF11OXTR | |
| SCHEMBL574073 | 0.60 | KIF11 (0.35) | KIF11OXTR | |
| SCHEMBL15026267 | 0.60 | CCKAR (0.39) | KIF11KMT2AMEN1OXTR |
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-111417657-A | Asymmetric ansa-metallocene catalyst compounds for the preparation of polyolefins having broad molecular weight distribution | 埃克森美孚化学专利公司 | 2020-07-14 | — | — | CN | disclosed |
| CN-111406078-A | Catalyst for preparing polyethylene with broad bimodal molecular weight distribution | 埃克森美孚化学专利公司 | 2020-07-10 | — | — | CN | disclosed |