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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | S100B | P04271 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TERT | O14746 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL457496 | 0.98 | ALDH1A1 (0.61) | ALDH1A1CYP3A4S100BACHEGFER | |
| SCHEMBL30565134 | 0.98 | ALDH1A1 (0.61) | ALDH1A1CYP3A4S100BACHEGFER | |
| Hydrochloric Acid SCHEMBL8958612 | 0.96 | ALDH1A1 (0.59) | ALDH1A1CYP3A4S100BACHEGFER | |
| SCHEMBL21065767 | 0.96 | ALDH1A1 (0.59) | ALDH1A1CYP3A4S100BACHEGFER | |
| SCHEMBL14283563 | 0.90 | ALDH1A1 (0.53) | ALDH1A1CYP3A4S100BACHEGFER | |
| SCHEMBL9365623 | 0.89 | ALDH1A1 (0.52) | ALDH1A1CYP3A4S100BACHEGFER | |
| Hydrochloric Acid SCHEMBL9437914 | 0.88 | ALDH1A1 (0.50) | ALDH1A1CYP3A4S100BACHEGFER | |
| SCHEMBL12470976 | 0.87 | ALDH1A1 (0.50) | ALDH1A1CYP3A4S100BGFERMAPT | |
| SCHEMBL681549 | 0.86 | ALDH1A1 (0.48) | ALDH1A1CYP3A4ACHEGFERMAPT | |
| SCHEMBL9644057 | 0.86 | ALDH1A1 (0.48) | ALDH1A1CYP3A4S100BACHEGFER |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10766972-B2 | Modified conjugated diene-based polymer and method for producing the same, and modified conjugated diene-based polymer composition | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2020-09-08 | — | — | US | disclosed |
| EP-3260476-B1 | MODIFIED CONJUGATED DIENE-BASED POLYMER, MANUFACTURING METHOD THEREOF, AND MODIFIED CONJUGATED DIENE-BASED POLYMER COMPOSITION | ASAHI CHEMICAL IND (JP) | 2019-05-08 | — | — | EP | disclosed |
| US-20180037674-A1 | Modified Conjugated Diene-Based Polymer and Method for Producing the Same, and Modified Conjugated Diene-Based Polymer Composition | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2018-02-08 | — | — | US | disclosed |
| EP-3260476-A1 | MODIFIED CONJUGATED DIENE-BASED POLYMER, MANUFACTURING METHOD THEREOF, AND MODIFIED CONJUGATED DIENE-BASED POLYMER COMPOSITION | Asahi Kasei Kabushiki Kaisha (JP) | 2017-12-27 | — | — | EP | disclosed |