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 | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7865332 | 0.84 | TDP1 (0.38) | TDP1ALDH1A1CA12CA1CA2 | |
| SCHEMBL677360 | 0.83 | TDP1 (0.44) | TDP1ALDH1A1CA12CA1CA2 | |
| SCHEMBL7865327 | 0.81 | TDP1 (0.43) | TDP1ALDH1A1CA12CA1CA2 | |
| SCHEMBL14397681 | 0.79 | TDP1 (0.34) | TDP1ALDH1A1CA12CA1CA2 | |
| Lithium Ion SCHEMBL6856332 | 0.79 | CA2 (0.39) | CA12CA1CA2CA9LMNA | |
| SCHEMBL7039707 | 0.78 | PTPN1 (0.40) | TDP1ALDH1A1CA12CA1CA2 | |
| SCHEMBL6850429 | 0.77 | PTPN1 (0.39) | TDP1ALDH1A1CA12CA1CA2 | |
| SCHEMBL14838145 | 0.76 | TDP1 (0.62) | TDP1ALDH1A1CA12CA1CA2 | |
| SCHEMBL8108082 | 0.76 | ALDH1A1 (0.46) | TDP1ALDH1A1HDAC8TSHRPIM1 | |
| SCHEMBL14355068 | 0.75 | TDP1 (0.31) | TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1095071-B1 | AROMATIC POLYMERS WITH PENDANT FLUORINATED IONIC GROUPS | DU PONT (US) | 2004-06-16 | — | — | EP | disclosed |
| EP-1095071-A1 | AROMATIC POLYMERS WITH PENDANT FLUORINATED IONIC GROUPS | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2001-05-02 | — | — | EP | disclosed |
| WO-1999067304-A1 | AROMATIC POLYMERS WITH PENDANT FLUORINATED IONIC GROUPS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1999-12-29 | — | — | WO | disclosed |