Sulfuric Acid

Sulfuric Acid

SCHEMBL6263792

O=S(=O)(O)O.[CH2]COc1ccccc1CC=C

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CALCRLCHRM1CHRM2CHRM3F2RMAOAMAOBMAP2K1MAP2K2NTRK1NTRK2NTRK3OPRD1OPRK1OPRM1P2RY12PKLRSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASLC18A2SLC6A2SLC6A3TLR7TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8dacAdacBdacCfolAftsImrcAmrcBmrdApolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmB1rpmB2rpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmHrpmIrpmJrpmJ2rpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsR1rpsR2rpsSrpsTrpsUrpsZykgMykgO

The experimentally established mechanism targets of Sulfuric Acid. 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
ADRB2 known ✓ P07550 6/20 0.47
ADRB1 known ✓ P08588 4/20 0.47
ADRA2C known ✓ P18825 2/20 0.47
ADRB3 known ✓ P13945 2/20 0.47
SLC6A2 known ✓ P23975 1/20 0.47
ADRA1A known ✓ P35348 1/20 0.47
ADRA2A known ✓ P08913 1/20 0.45
ADRA2B known ✓ P18089 1/20 0.45
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 4/20 0.48
HTR1A P08908 3/20 0.47
LMNA P02545 2/20 0.47
BDKRB2 P30411 1/20 0.47
SLC6A4 P31645 1/20 0.47
HTR2B P41595 1/20 0.47
KCNH2 Q12809 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 1/20 0.47
NFKB1 P19838 1/20 0.47

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
SCHEMBL173232 0.90 KDM4E (0.54) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL1678480 0.85 ICAM1 (0.47) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL3478566 0.84 KDM4E (0.52) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL6263795 0.83 ICAM1 (0.46) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL11324839 0.83 ICAM1 (0.46) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL1074745 0.83 ICAM1 (0.46) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL9770145 0.83 ICAM1 (0.46) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL21225308 0.82 ICAM1 (0.45) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL10413226 0.82 ALDH1A1 (0.43) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL14860877 0.81 KDM4E (0.49) ALDH1A1KDM4EADRB2ADRB1HTR1A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948997-B1 Manufacturing method of absorbent resin NIPPON CATALYTIC CHEM IND (JP) 2005-07-20 EP disclosed
US-6291636-B1 DRYING HYDROGEL OF A CROSSLINKED POLYMER; PULVERIZING; SEPARATING NIPPON SHOKUBAI CO., LTD. (JP) 2001-09-18 US disclosed
EP-0948997-A2 Manufacturing method of absorbent resin Nippon Shokubai Co., Ltd. (JP) 1999-10-13 EP disclosed
EP-0379174-A2 2,3-Dihydro-3,3-dimethyl-5-trifluoromethanesulfonyloxybenzofurans, process for producing them and herbicides containing them MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-07-25 EP disclosed