Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 known ✓ | P00915 | 1/20 | 0.33 |
| ▸ | CA4 known ✓ | P22748 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 2/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | CCR2 | P41597 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29424652 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| SCHEMBL6917759 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| SCHEMBL6914415 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| SCHEMBL6916976 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| Zinc Ion SCHEMBL6915751 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| SCHEMBL6916823 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| SCHEMBL6916415 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| SCHEMBL6916423 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| SCHEMBL6918751 | 0.95 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 | |
| SCHEMBL6913832 | 0.92 | FFAR3 (0.39) | ALDH1A1SMN1; SMN2FFAR3CETPP2RX7 |
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-5185159-A | Antiepeleptic agents; tablets | SANOFI (FR) | 1993-02-09 | — | — | US | disclosed |
| US-5017613-A | Valproic acid preparations | SANOFI, S. A. (FR) | 1991-05-21 | — | — | US | disclosed |
| US-4423071-A | ANOXIA, ANTICONVULSANTS, GLYCERYL BIS-(DI-N-PROPYLACETATES) | SANOFI (FR) | 1983-12-27 | — | — | US | disclosed |
| US-4283420-A | ANTICONVULSANTS, ANTIANAPHYLACTIC AGENTS, ANTIPSYCHOTIC AGENTS | LABAZ (FR) | 1981-08-11 | — | — | US | disclosed |