Sulfuric Acid

Sulfuric Acid

SCHEMBL16735342

CCCCCCCCCCCCOC(C)CN.CCCCCCCCCCCCOC(C)CN.O=S(=O)(O)O

nearest known ligand 0.52

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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
DNM1 Q05193 1/20 0.52
TP53 P04637 1/20 0.47
CA1 P00915 9/20 0.44
CA2 P00918 9/20 0.44
CA9 Q16790 8/20 0.44
CA12 O43570 3/20 0.44
CA7 P43166 3/20 0.44
CA14 Q9ULX7 3/20 0.44
CA3 P07451 2/20 0.44
CA4 P22748 2/20 0.44
CA6 P23280 2/20 0.44
CA5A P35218 2/20 0.44
CA5B Q9Y2D0 2/20 0.44
HTT P42858 1/20 0.43
RECQL P46063 2/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
EPHX2 P34913 1/20 0.39

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
Sulfuric Acid SCHEMBL130672 1.00 DNM1 (0.52) DNM1TP53CA1CA2CA9
SCHEMBL8399166 0.89 DNM1 (0.63) DNM1CA1CA2CA9HTT
SCHEMBL6872756 0.89 DNM1 (0.63) DNM1CA1CA2CA9HTT
Bromide SCHEMBL30017166 0.87 DNM1 (0.61) DNM1CA1CA2CA9HTT
SCHEMBL11654487 0.87 DNM1 (0.59) DNM1CA1CA2CA9HTT
SCHEMBL10003957 0.81 DNM1 (0.55) DNM1HTTTLR2
Sulfuric Acid SCHEMBL31520303 0.81 TP53 (0.48) DNM1TP53CA1CA2CA9
SCHEMBL10943226 0.80
SCHEMBL27741674 0.80 CA1 (0.41) DNM1TP53CA1CA2CA9
SCHEMBL17817246 0.80 CA1 (0.41) DNM1TP53CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2876154-B1 AN ADHESIVE DETERGENT AND/OR PERFUMING COMPOSITION BOLTON MANITOBA SPA (IT) 2019-07-24 EP claimed
US-20150148281-A1 ADHESIVE DETERGENT AND/OR PERFUMING COMPOSITION BOLTON MANITOBA S.P.A. (IT) 2015-05-28 US claimed
EP-2876154-A1 AN ADHESIVE DETERGENT AND/OR PERFUMING COMPOSITION Bolton Manitoba SpA (IT) 2015-05-27 EP claimed
EP-2876154-B1 AN ADHESIVE DETERGENT AND/OR PERFUMING COMPOSITION BOLTON MANITOBA SPA (IT) 2019-07-24 EP disclosed
US-20150148281-A1 ADHESIVE DETERGENT AND/OR PERFUMING COMPOSITION BOLTON MANITOBA S.P.A. (IT) 2015-05-28 US disclosed
EP-2876154-A1 AN ADHESIVE DETERGENT AND/OR PERFUMING COMPOSITION Bolton Manitoba SpA (IT) 2015-05-27 EP disclosed