Methane

Methane

SCHEMBL9838465

C.CCCCCOC(=O)C(CCCCC)(CC(=O)[O-])S(=O)(=O)O.[Na+]

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Methane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 1/20 0.32
NAAA Q02083 1/20 0.35
TSHR P16473 4/20 0.34
RECQL P46063 2/20 0.34
MAPK1 P28482 2/20 0.34
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34
EPHX2 P34913 1/20 0.34
BLM P54132 1/20 0.34
EPHX1 P07099 1/20 0.33
HTR2C P28335 1/20 0.33
HCAR2 Q8TDS4 2/20 0.32
CES2 O00748 1/20 0.32
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL9814071 0.97 NAAA (0.38) NAAATSHRRECQLMAPK1GLA
SCHEMBL3329233 0.97 NAAA (0.38) NAAATSHRRECQLMAPK1GLA
SCHEMBL11051162 0.97 NAAA (0.38) NAAATSHRRECQLMAPK1GLA
SCHEMBL198244 0.97 NAAA (0.38) NAAATSHRRECQLMAPK1GLA
SCHEMBL18527025 0.97 NAAA (0.38) NAAATSHRRECQLMAPK1GLA
SCHEMBL18010665 0.97 NAAA (0.38) NAAATSHRRECQLMAPK1GLA
Potassium Ion SCHEMBL5028598 0.95 NAAA (0.38) NAAATSHRRECQLMAPK1GLA
SCHEMBL11420160 0.95 NAAA (0.35) NAAATSHRRECQLMAPK1GLA
SCHEMBL721510 0.88 NAAA (0.39) NAAATSHRRECQLMAPK1GLA
SCHEMBL28517091 0.88 MEN1 (0.43) TSHRRECQLMAPK1GLAHPGD

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4983478-A Burn-in gumming composition for offset printing plates HOECHST AKTIENGESELLSCHAFT (DE) 1991-01-08 US disclosed
US-4885230-A Burn-in gumming composition for offset printing plates HOECHST AKTIENGESELLSCHAFT (DE) 1989-12-05 US disclosed