Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29381110 | 0.95 | CYP3A4 (0.32) | CYP3A4TSHRNFKB1NPSR1CA12 | |
| SCHEMBL30643192 | 0.95 | CYP3A4 (0.32) | CYP3A4TSHRNFKB1NPSR1CA12 | |
| SCHEMBL6426968 | 0.95 | TSHR (0.36) | CYP3A4TSHRNFKB1NPSR1CA12 | |
| Lithium Ion SCHEMBL6426738 | 0.95 | CYP3A4 (0.32) | CYP3A4TSHRNFKB1NPSR1CA12 | |
| Potassium Ion SCHEMBL1133907 | 0.95 | CYP3A4 (0.32) | CYP3A4TSHRNFKB1NPSR1CA12 | |
| Tetrylammonium SCHEMBL19811267 | 0.87 | TSHR (0.33) | TSHRNFKB1 | |
| Tetrabuthylammonium SCHEMBL1111675 | 0.82 | SLC22A1 (0.44) | CYP3A4TSHRCA2 | |
| Lithium Ion SCHEMBL19811155 | 0.81 | CA2 (0.34) | TSHRCA1CA2 | |
| SCHEMBL19811115 | 0.81 | CA2 (0.38) | TSHRCA2 | |
| Potassium Ion SCHEMBL19811679 | 0.81 | FDFT1 (0.35) | TSHRCA2 |
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-9515317-B2 | Surface treating method of negative electrode for magnesium secondary battery, negative electrode for magnesium secondary battery, and magnesium secondary battery | DENSO CORPORATION (JP) | 2016-12-06 | — | — | US | disclosed |
| US-8986887-B2 | Magnesium secondary battery | DENSO CORPORATION (JP) | 2015-03-24 | — | — | US | disclosed |
| US-20140174935-A1 | SURFACE TREATING METHOD OF NEGATIVE ELECTRODE FOR MAGNESIUM SECONDARY BATTERY, NEGATIVE ELECTRODE FOR MAGNESIUM SECONDARY BATTERY, AND MAGNESIUM SECONDARY BATTERY | DENSO CORPORATION (JP) | 2014-06-26 | — | — | US | disclosed |
| US-20140045071-A1 | MAGNESIUM SECONDARY BATTERY | DENSO CORPORATION (JP) | 2014-02-13 | — | — | US | disclosed |