Sulfuric Acid

Sulfuric Acid

SCHEMBL6676980

O=C(O)Cc1cccnc1.O=S(=O)([O-])O.[H+]

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CYP51cyp51Acyp51c

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 9)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.77
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
TBXAS1 P24557 10/20 0.50
NAMPT P43490 2/20 0.47
KDM4E B2RXH2 1/20 0.46
AKR1B1 P15121 1/20 0.46
EPHX2 P34913 1/20 0.45

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 SCHEMBL6676982 0.92 NAPRT (0.86) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
SCHEMBL29430342 0.88 NAPRT (1.00) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
SCHEMBL48609 0.88 NAPRT (1.00) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
SCHEMBL26116267 0.86 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
SCHEMBL986770 0.86 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Hydrochloric Acid SCHEMBL177895 0.86 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Hydrochloric Acid SCHEMBL5332088 0.86 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Water SCHEMBL27728999 0.86 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Hydrochloric Acid SCHEMBL26689831 0.86 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Hydrochloric Acid SCHEMBL27823037 0.84 NAPRT (0.92) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1

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
WO-2004048385-A2 A PROCESS FOR THE PREPARATION OF CRYSTALLINE FORM 1 OR CLOPIDOGREL HYDROGEN SULFATE INSTYTUT FARMACEUTYCZNY (PL) 2004-06-10 WO claimed
WO-2004048385-A2 A PROCESS FOR THE PREPARATION OF CRYSTALLINE FORM 1 OR CLOPIDOGREL HYDROGEN SULFATE INSTYTUT FARMACEUTYCZNY (PL) 2004-06-10 WO disclosed