Sulfuric Acid

Sulfuric Acid

SCHEMBL8642015

Cc1cc(C)c(N)c(C)c1N.O=S(=O)(O)O

nearest known ligand 0.42

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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
ALDH1A1 P00352 5/20 0.42
CYP3A4 P08684 3/20 0.42
TSHR P16473 3/20 0.42
TP53 P04637 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 4/20 0.39
POLB P06746 2/20 0.37
MAPK1 P28482 2/20 0.36
GAA P10253 4/20 0.34
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
THRB P10828 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL262306 0.84 ALDH1A1 (0.56) ALDH1A1CYP3A4TSHRTP53TDP1
SCHEMBL8627896 0.82 RAPGEF4 (0.38) ALDH1A1CYP3A4TSHRTP53TDP1
Ammonia Solution, Strong SCHEMBL2045015 0.81 ALDH1A1 (0.53) ALDH1A1CYP3A4TSHRTP53TDP1
Hydrochloric Acid SCHEMBL8643161 0.81 ALDH1A1 (0.53) ALDH1A1CYP3A4TSHRTP53TDP1
Sulfuric Acid SCHEMBL2004160 0.80 KDM4E (0.54) ALDH1A1CYP3A4TSHRTP53TDP1
Phosphonic Acid SCHEMBL21802354 0.80 ALDH1A1 (0.42) ALDH1A1CYP3A4TSHRTP53TDP1
Sulfuric Acid SCHEMBL8521097 0.80 ALDH1A1 (0.70) ALDH1A1CYP3A4TSHRTP53TDP1
SCHEMBL3389856 0.78 ALDH1A1 (0.50) ALDH1A1CYP3A4TSHRTP53TDP1
SCHEMBL2032295 0.78 SENP2 (0.40) ALDH1A1CYP3A4TSHRTP53TDP1
SCHEMBL8217255 0.78 LMNA (0.40) ALDH1A1CYP3A4TSHRTP53TDP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5821320-A MIXING AROMATIC DIAMINE DIHYDROCHLORIDE OR SULFATE WITH AROMATIC ACID DIANHYDRIDE, HEATING TO DEHYDRATE AND CONDENSE PETROLEUM ENERGY CENTER (JP) 1998-10-13 US disclosed