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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 known ✓ | P00915 | 3/20 | 0.43 |
| ▸ | CA2 known ✓ | P00918 | 2/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
| ▸ | BBOX1 | O75936 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7110445 | 0.87 | LMNA (0.40) | LMNAMMP1MMP2MMP3MMP9 | |
| SCHEMBL2608669 | 0.87 | LMNA (0.40) | LMNAMMP1MMP2MMP3MMP9 | |
| Acetic Acid SCHEMBL22769870 | 0.83 | LMNA (0.38) | FFAR3LMNAMMP1MMP2MMP3 | |
| SCHEMBL9817250 | 0.81 | LMNA (0.50) | LMNAMMP1MMP2MMP3MMP9 | |
| SCHEMBL935213 | 0.81 | EGLN1 (0.45) | FFAR3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL11411203 | 0.81 | CA1 (0.41) | CA1ELANEFFAR3HDAC3HDAC1 | |
| SCHEMBL18218913 | 0.79 | ALDH1A1 (0.43) | LMNAMMP1MMP2MMP3MMP9 | |
| SCHEMBL19107033 | 0.78 | LMNA (0.34) | LMNAMMP1MMP2MMP3MMP9 | |
| Potassium Ion SCHEMBL11403492 | 0.77 | CA1 (0.38) | CA1ELANEFFAR3HDAC3HDAC1 | |
| SCHEMBL18651161 | 0.77 | ALDH1A1 (0.48) | FFAR3HDAC3HDAC1HDAC2HDAC8 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9926578-B2 | Process for manufacturing butanediol | PURAC BIOCHEM BV (NL) | 2018-03-27 | — | — | US | disclosed |
| US-20160040194-A1 | Process for manufacturing butanediol | PURAC BIOCHEM BV (NL) | 2016-02-11 | — | — | US | disclosed |
| US-9162961-B2 | Process for manufacturing succinic acid | PURAC BIOCHEM BV (NL) | 2015-10-20 | — | — | US | disclosed |
| CN-102753514-B | Process for manufacturing succinic acid | PURAC BIOCHEM BV | 2014-11-26 | — | — | CN | disclosed |
| EP-2360137-B1 | Process for manufacturing succinic acid | PURAC BIOCHEM BV (NL) | 2013-08-07 | — | — | EP | disclosed |
| EP-2534124-A1 | PROCESS FOR MANUFACTURING SUCCINIC ACID | PURAC Biochem BV (NL) | 2012-12-19 | — | — | EP | disclosed |
| US-20120316368-A1 | PROCESS FOR MANUFACTURING SUCCINIC ACID | PURAC BIOCHEM BV (NL) | 2012-12-13 | — | — | US | disclosed |
| CN-102753514-A | Process for manufacturing succinic acid | PURAC BIOCHEM BV | 2012-10-24 | — | — | CN | disclosed |
| EP-2360137-A1 | Process for manufacturing succinic acid | PURAC Biochem BV (NL) | 2011-08-24 | — | — | EP | disclosed |
| WO-2011098598-A1 | PROCESS FOR MANUFACTURING SUCCINIC ACID | PURAC BIOCHEM BV (NL) | 2011-08-18 | — | — | WO | disclosed |