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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.53 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | GLS | O94925 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20024852 | 0.81 | NR1H2 (0.57) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL894282 | 0.81 | NR1H2 (0.57) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL21063461 | 0.80 | NR1H2 (0.49) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL19718007 | 0.80 | NR1H2 (0.55) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL7261502 | 0.79 | NR1H2 (0.54) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL447929 | 0.78 | NR1H2 (0.60) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL72498 | 0.78 | NR1H2 (0.75) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL10293026 | 0.78 | NR1H2 (0.60) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL15804474 | 0.78 | NR1H2 (0.60) | NR1H2NAMPTUSP2SMN1; SMN2MAPT | |
| SCHEMBL24676423 | 0.77 | NR1H2 (0.56) | NR1H2NAMPTUSP2SMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019118612-A1 | TARGETING COMPOUNDS | ZAFGEN, INC. (US) | 2019-06-20 | — | — | WO | disclosed |