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 2)
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 | |
|---|---|---|---|---|
| SCHEMBL7609814 | 0.93 | FNTA (0.73) | FNTAFNTB | |
| Lithium Ion SCHEMBL6773036 | 0.84 | FNTA (0.88) | FNTAFNTB | |
| Lithium Ion SCHEMBL7916526 | 0.84 | FNTA (0.66) | FNTAFNTB | |
| Lithium Ion SCHEMBL6777302 | 0.83 | FNTA (0.62) | FNTAFNTB | |
| Lithium Ion SCHEMBL6775179 | 0.82 | FNTA (0.69) | FNTAFNTB | |
| Lithium Ion SCHEMBL6770683 | 0.81 | FNTA (0.64) | FNTAFNTB | |
| Lithium Ion SCHEMBL7918476 | 0.80 | FNTA (0.66) | FNTAFNTB | |
| SCHEMBL7607952 | 0.80 | FNTA (0.75) | FNTAFNTB | |
| SCHEMBL7607958 | 0.80 | FNTA (0.75) | FNTAFNTB | |
| Lithium Ion SCHEMBL7921395 | 0.79 | FNTA (0.59) | FNTAFNTB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6693123-B2 | (4-(3-PYRIDYLAMINOMETHYLENE)-2-PHENYLBENZOYL)-N -METHYLMETHIONINE, METHYL ESTER FOR EXAMPLE; RESTENOSIS, HYPERPLASIA | UNIVERSITY OF PITTSBURGH | 2004-02-17 | — | — | US | disclosed |