Sulfuric Acid

Sulfuric Acid

SCHEMBL28119489

ClN(Cl)c1ccccc1.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.45

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
SMN1; SMN2 Q16637 2/20 0.44
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 2/20 0.42
ESR1 P03372 2/20 0.41
HSP90AA1 P07900 1/20 0.41
ALDH1A1 P00352 5/20 0.40
HTT P42858 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
PKM P14618 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.37

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 SCHEMBL11025326 1.00 SMN1; SMN2 (0.44) SMN1; SMN2TSHRNPSR1ESR1HSP90AA1
SCHEMBL18812 0.84
Benzene SCHEMBL27358958 0.84 ALDH1A1 (0.41) TSHRNPSR1HSP90AA1ALDH1A1HTT
Sulfuric Acid SCHEMBL28130681 0.81 SMN1; SMN2 (0.41) SMN1; SMN2TSHRNPSR1ESR1HSP90AA1
SCHEMBL28381795 0.81 ALDH1A1 (0.39) TSHRNPSR1HSP90AA1ALDH1A1HTT
Hydrochloric Acid SCHEMBL8530750 0.81 ALDH1A1 (0.39) TSHRNPSR1HSP90AA1ALDH1A1HTT
Acetic Acid SCHEMBL27535503 0.80 NPSR1 (0.48) SMN1; SMN2TSHRNPSR1ALDH1A1HTT
Benzene SCHEMBL27725908 0.80 NPSR1 (0.48) SMN1; SMN2TSHRNPSR1ALDH1A1HTT
Carbamic Acid SCHEMBL27434505 0.80 NPSR1 (0.48) SMN1; SMN2TSHRNPSR1ALDH1A1HTT
Nitrogen SCHEMBL4342761 0.78 ALDH1A1 (0.38) TSHRNPSR1HSP90AA1ALDH1A1HTT

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
CN-106458809-A Process for making 2,5-dihalogenated phenol 巴斯夫欧洲公司 2017-02-22 CN disclosed