Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.87 |
| ▸ | PDE4A | P27815 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 2/20 | 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 | |
|---|---|---|---|---|
| Calcium Gluceptate SCHEMBL517448 | 1.00 | LMNA (0.87) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| Calcium Gluceptate SCHEMBL29361230 | 1.00 | LMNA (0.87) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| Calcium Gluceptate SCHEMBL29877402 | 1.00 | LMNA (0.87) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| Calcium Gluceptate SCHEMBL517446 | 1.00 | LMNA (0.87) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| Calcium Gluceptate SCHEMBL517447 | 1.00 | LMNA (0.87) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| SCHEMBL28073209 | 0.98 | LMNA (0.83) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| Water SCHEMBL29706462 | 0.98 | LMNA (0.83) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| Gluconic Acid SCHEMBL23415272 | 0.98 | LMNA (0.91) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| Gluconic Acid SCHEMBL24132 | 0.98 | LMNA (0.91) | LMNAPDE4ATDP1L3MBTL1USP2 | |
| Gluconic Acid SCHEMBL16180766 | 0.98 | LMNA (0.91) | LMNAPDE4ATDP1L3MBTL1USP2 |
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-20040106678-A1 | Compositions for the parenteral administration of calcium and magnesium | DOBBINS THOMAS A | 2004-06-03 | — | — | US | disclosed |