Sulfuric Acid

Sulfuric Acid

SCHEMBL4612293

Nc1nc(N)c(N)c(N)n1.Nc1nc(N)c(N)c(N)n1.O=S(=O)(O)O

nearest known ligand 0.35

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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 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.34
DHFR P00374 2/20 0.33
CA5A P35218 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
CYP1A2 P05177 1/20 0.31
HSP90AB1 P08238 1/20 0.31
BLM P54132 1/20 0.30
KDM4E B2RXH2 1/20 0.30
CCNA2 P20248 1/20 0.30
CDK2 P24941 1/20 0.30
CCNA1 P78396 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
TSHR P16473 1/20 0.30
NT5E P21589 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
MAPT P10636 1/20 0.30

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 SCHEMBL121743 1.00 PDPK1 (0.34) PDPK1DHFRCA5ACA5BCYP1A2
Sulfuric Acid SCHEMBL20815930 1.00 PDPK1 (0.34) PDPK1DHFRCA5ACA5BCYP1A2
Sulfuric Acid SCHEMBL9621165 0.97 PDPK1 (0.33) PDPK1DHFRCA5ACA5BCYP1A2
Sulfuric Acid SCHEMBL28283741 0.85 CYP1A2 (0.31) PDPK1DHFRCYP1A2MAPT
SCHEMBL20815929 0.85 CCNA2 (0.31) PDPK1CCNA2CDK2CCNA1
Sulfuric Acid SCHEMBL4826011 0.85 CYP1A2 (0.31) PDPK1DHFRCYP1A2MAPT
Sulfuric Acid SCHEMBL94088 0.85 CYP1A2 (0.31) PDPK1DHFRCYP1A2MAPT
Sulfuric Acid SCHEMBL10391851 0.84 CYP1A2 (0.30) DHFRCYP1A2
Sulfuric Acid SCHEMBL3344978 0.82 CA5A (0.43) CA5ACA5BCYP1A2BLMKDM4E
Sulfuric Acid SCHEMBL129071 0.82 CA5A (0.43) CA5ACA5BCYP1A2BLMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1985282-A2 Dyeing method with shortened application time Henkel AG & Co. KGaA (DE) 2008-10-29 EP claimed
EP-1985282-A2 Dyeing method with shortened application time Henkel AG & Co. KGaA (DE) 2008-10-29 EP disclosed