Sulfuric Acid

Sulfuric Acid

SCHEMBL10347307

CN(C)C1Cc2c[nH]c3ccc(N)c(c23)C1.O=S(=O)(O)O

nearest known ligand 0.65

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Known targets — ChEMBL curated mechanism

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

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 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.46
HTR1D P28221 9/20 0.43
HTR1B P28222 8/20 0.43
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
DRD2 P14416 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
SCHEMBL8893706 0.77 HTR1A (0.59) HTR1AHTR1DHTR1BMTNR1AMTNR1B
SCHEMBL23261949 0.76 HTR1A (0.45) HTR1AHTR1DHTR1BMTNR1AMTNR1B
SCHEMBL23261946 0.76 HTR1A (0.45) HTR1AHTR1DHTR1B
Sulfuric Acid SCHEMBL7524443 0.75 HTR1A (0.56) HTR1AHTR1DHTR1BDRD2
SCHEMBL9790366 0.74 MTNR1A (0.57) HTR1AHTR1DHTR1BMTNR1AMTNR1B
Sulfuric Acid SCHEMBL10347223 0.71 HTR1A (0.75) HTR1AHTR1DHTR1BDRD2
Bromide SCHEMBL9790390 0.71 HTR1A (0.49) HTR1AHTR1DHTR1BMTNR1AMTNR1B
SCHEMBL7516412 0.68 HTR1A (0.60) HTR1AHTR1DHTR1BDRD2
Iodide SCHEMBL7514820 0.68 HTR1A (0.59) HTR1AHTR1DHTR1BDRD2
SCHEMBL23261836 0.67 HTR1A (0.37) HTR1AHTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0153083-B1 6-SUBSTITUTED-4-DIALKYLAMINOTETRAHYDROBENZ(C,D)INDOLES ELI LILLY AND COMPANY (US) 1990-05-23 EP disclosed
US-4576959-A ANTIDEPRESSANTS ELI LILLY AND COMPANY (US) 1986-03-18 US disclosed
EP-0153083-A2 6-Substituted-4-dialkylaminotetrahydrobenz(c,d)indoles ELI LILLY AND COMPANY (US) 1985-08-28 EP disclosed