Sulfuric Acid

Sulfuric Acid

SCHEMBL11698488

CCCSC(=N)N.O=S(=O)(O)O

nearest known ligand 0.77

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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
NOS1 P29475 4/20 0.77
NOS3 P29474 4/20 0.77
NOS2 P35228 4/20 0.77
LMNA P02545 3/20 0.59
CYP1A2 P05177 5/20 0.52
HRH4 Q9H3N8 5/20 0.52
CYP2C19 P33261 4/20 0.52
CYP2D6 P10635 2/20 0.52
BLM P54132 2/20 0.52
KDM4E B2RXH2 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TSHR P16473 2/20 0.48
TDP1 Q9NUW8 4/20 0.46
MAPT P10636 3/20 0.46
ALDH1A1 P00352 3/20 0.45
CYP3A4 P08684 1/20 0.44
APEX1 P27695 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HRH2 P25021 1/20 0.42
HSD17B10 Q99714 1/20 0.41

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 SCHEMBL11698495 0.90 NOS1 (0.68) NOS1NOS3NOS2LMNACYP1A2
SCHEMBL7566193 0.88
Bromide SCHEMBL28063297 0.85
Iodide SCHEMBL31317548 0.85
Bromide SCHEMBL31317494 0.85
Hydrochloric Acid SCHEMBL31317493 0.85
Sulfuric Acid SCHEMBL11528486 0.84 NOS1 (0.67) NOS1NOS3NOS2LMNACYP1A2
Ethylisothiourea SCHEMBL4409267 0.81 CYP2C19 (0.75) NOS1NOS3NOS2LMNACYP1A2
Sulfuric Acid SCHEMBL4408205 0.79 CYP1A2 (0.76) NOS1NOS3NOS2LMNACYP1A2
Sulfuric Acid SCHEMBL28092888 0.76 CYP1A2 (0.43) NOS1NOS3NOS2LMNACYP1A2

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-4046884-A N-(α-Aminoalkylidene)phosphor- and phosphonamidates, and method for controlling insects VELSICOL CHEMICAL CORPORATION (US) 1977-09-06 US disclosed