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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 10/20 | 0.69 |
| ▸ | MEN1 | O00255 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.62 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.57 |
| ▸ | CCR1 | P32246 | 2/20 | 0.53 |
| ▸ | CCR3 | P51677 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4034199 | 0.87 | SIGMAR1 (0.73) | SIGMAR1MEN1KMT2AMCHR1CCR1 | |
| SCHEMBL4202919 | 0.87 | SIGMAR1 (0.70) | SIGMAR1MEN1KMT2AMCHR1CCR1 | |
| SCHEMBL4031569 | 0.85 | SIGMAR1 (0.67) | SIGMAR1MEN1KMT2AMCHR1CCR1 | |
| SCHEMBL2213082 | 0.84 | SIGMAR1 (0.76) | SIGMAR1MEN1KMT2AMCHR1CCR1 | |
| SCHEMBL7487718 | 0.83 | SIGMAR1 (0.74) | SIGMAR1MEN1KMT2AMCHR1CCR1 | |
| SCHEMBL6312739 | 0.82 | SIGMAR1 (0.76) | SIGMAR1MEN1KMT2AMCHR1KDM4E | |
| SCHEMBL6327856 | 0.81 | SIGMAR1 (0.71) | SIGMAR1MEN1KMT2AMCHR1CCR1 | |
| SCHEMBL4034602 | 0.81 | SIGMAR1 (0.83) | SIGMAR1MEN1KMT2AMCHR1 | |
| SCHEMBL4199167 | 0.81 | SIGMAR1 (0.68) | SIGMAR1MEN1KMT2AMCHR1CCR1 | |
| SCHEMBL12511819 | 0.81 | SIGMAR1 (0.70) | SIGMAR1MEN1KMT2AMCHR1CCR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1212299-B1 | SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | ASTRAZENECA UK LTD (GB) | 2009-04-08 | — | — | EP | disclosed |
| US-20050250792-A1 | Substituted piperidine compounds useful as modulators of chemokine receptor activity | MERRILL LYNCH CAPITAL, A DIVISION OF MERRILL LYNCH BUSINESS FINANCIAL SERVICES, INC. AS ADMINISTRATIVE AGENT | 2005-11-10 | — | — | US | disclosed |
| US-6903085-B1 | Substituted piperidine compounds useful as modulators of chemokine receptor activity | ASTRAZENECA, AB (CH) | 2005-06-07 | — | — | US | disclosed |
| EP-1212299-A1 | SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | AstraZeneca UK Limited (GB) | 2002-06-12 | — | — | EP | disclosed |
| WO-2001014333-A1 | SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | ASTRAZENECA UK LIMITED (GB) | 2001-03-01 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20050250792-A1 | Substituted piperidine compounds useful as modulators of chemokine receptor activity | CXCR4, CXCR1, CXCR3 | SIGMAR1 126/4885MEN1 4130/4885KMT2A 2580/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.