Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Isosorbide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB known ✓ | P10828 | 1/20 | 0.65 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GSR | P00390 | 3/20 | 0.33 |
| ▸ | BCHE | P06276 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Isosorbide SCHEMBL2129898 | 0.90 | THRB (0.65) | THRBLMNAMAPTALDH1A1GSR | |
| Isosorbide SCHEMBL3388024 | 0.90 | THRB (0.65) | THRBLMNAMAPTALDH1A1GSR | |
| Isosorbide SCHEMBL4353400 | 0.90 | THRB (0.65) | THRBLMNAMAPTALDH1A1GSR | |
| Isosorbide SCHEMBL5699287 | 0.90 | THRB (0.65) | THRBLMNAMAPTALDH1A1GSR | |
| Isosorbide SCHEMBL5170125 | 0.90 | THRB (0.65) | THRBLMNAMAPTALDH1A1GSR | |
| Isosorbide SCHEMBL217707 | 0.90 | THRB (0.65) | THRBLMNAMAPTALDH1A1GSR | |
| Isosorbide SCHEMBL8414428 | 0.89 | THRB (0.56) | THRBLMNAMAPTALDH1A1GSR | |
| Isosorbide SCHEMBL24465084 | 0.81 | THRB (1.00) | THRBLMNAMAPTBCHE | |
| Isosorbide SCHEMBL9882796 | 0.81 | THRB (1.00) | THRBLMNAMAPTBCHE | |
| Isosorbide SCHEMBL6105354 | 0.81 | THRB (1.00) | THRBLMNAMAPTBCHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110407846-B | Preparation method of 5-isosorbide mononitrate | 鲁南制药集团股份有限公司 | 2021-09-14 | — | — | CN | disclosed |
| CN-103641840-A | Method for synthesizing and purifying 5-isosorbide mononitrate | QINGDAO HUANGHAI PHARMACEUTICAL CO LTD | 2014-03-19 | — | — | CN | disclosed |