Sulfuric Acid

Sulfuric Acid

SCHEMBL7955030

CC1CC(c2coc3ccccc23)CCN1.O=S(=O)(O)O

nearest known ligand 0.43

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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 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 17/20 0.43
SLC6A4 P31645 1/20 0.43
HTR2A P28223 16/20 0.41
DRD3 P35462 16/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 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 SCHEMBL7955029 1.00 DRD2 (0.43) DRD2SLC6A4HTR2ADRD3CHRNB2
Sulfuric Acid SCHEMBL7955031 1.00 DRD2 (0.43) DRD2SLC6A4HTR2ADRD3CHRNB2
SCHEMBL6599214 0.75 SLC6A4 (0.42) DRD2SLC6A4HTR2ADRD3
SCHEMBL6599220 0.75 SLC6A4 (0.42) DRD2SLC6A4HTR2ADRD3
SCHEMBL13584551 0.73 SLC6A4 (0.55) DRD2SLC6A4HTR2ADRD3CHRNB2
Sulfuric Acid SCHEMBL7964601 0.70 RAB9A (0.36) HTR2ANPC1ALDH1A1RAB9ASMN1; SMN2
Sulfuric Acid SCHEMBL8311600 0.70 RAB9A (0.36) HTR2ANPC1ALDH1A1RAB9ASMN1; SMN2
Sulfuric Acid SCHEMBL7964604 0.70 RAB9A (0.36) HTR2ANPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL12649229 0.67 DRD2 (0.50) DRD2SLC6A4HTR2ADRD3CHRNB2
SCHEMBL7966226 0.67 DRD2 (0.39) DRD2HTR2A

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
US-6303627-B1 FOR THERAPY OF PHYSIOLOGICAL AND PSYCHOLOGICAL DISORDERS ELI LILLY AND COMPANY 2001-10-16 US disclosed
WO-1999065487-A1 INHIBITORS OF SEROTONIN REUPTAKE ELI LILLY AND COMPANY (US) 1999-12-23 WO disclosed
EP-0965587-A1 Tetrahydropyridinyl- and piperidinyl Inhibitors of serotonin reuptake ELI LILLY AND COMPANY (US) 1999-12-22 EP disclosed