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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | S100B | P04271 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29520654 | 0.98 | CYP3A4 (0.46) | CYP3A4LMNATSHRACHENPSR1 | |
| SCHEMBL328909 | 0.98 | CYP3A4 (0.46) | CYP3A4LMNATSHRACHENPSR1 | |
| SCHEMBL21065758 | 0.95 | CYP3A4 (0.44) | CYP3A4LMNATSHRACHENPSR1 | |
| Nitrogen SCHEMBL11335665 | 0.91 | CYP3A4 (0.42) | CYP3A4LMNATSHRACHENPSR1 | |
| SCHEMBL16577642 | 0.88 | CYP3A4 (0.43) | CYP3A4LMNATSHRACHENPSR1 | |
| O-Tolylamine SCHEMBL11740502 | 0.86 | CYP3A4 (0.56) | CYP3A4LMNATSHRNPSR1MAPT | |
| SCHEMBL19002230 | 0.85 | CYP3A4 (0.41) | CYP3A4LMNATSHRACHENPSR1 | |
| SCHEMBL28126580 | 0.82 | SIGMAR1 (0.38) | CYP3A4LMNATSHRNPSR1MAPT | |
| SCHEMBL8067265 | 0.82 | CYP3A4 (0.47) | CYP3A4LMNATSHRNPSR1MAPT | |
| Lithium Ion SCHEMBL19732781 | 0.82 | CRHR1 (0.43) | CYP3A4LMNATSHRACHEALDH1A1 |
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 |