Potassium

Potassium

SCHEMBL7999066

O=C(O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)O.[K].[Na]

nearest known ligand 0.55

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.55
TDP1 Q9NUW8 2/20 0.55
CYP3A4 P08684 1/20 0.55
ALOX15 P16050 1/20 0.55
KMT2A Q03164 3/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.48
NT5E P21589 1/20 0.46
TP53 P04637 2/20 0.44
HTT P42858 1/20 0.44
CTSV O60911 1/20 0.44
CTSL P07711 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
FLT1 P17948 2/20 0.43
FLT4 P35916 2/20 0.43
KDR P35968 2/20 0.43
CES2 O00748 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL2983082 0.97 ALDH1A1 (0.58) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL7026429 0.95 ALDH1A1 (0.57) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL7026439 0.95 ALDH1A1 (0.57) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL2967553 0.95 ALDH1A1 (0.57) ALDH1A1TDP1CYP3A4ALOX15KMT2A
Potassium Ion SCHEMBL2983136 0.95 ALDH1A1 (0.57) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL2979886 0.95 ALDH1A1 (0.57) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL7999063 0.94 ALDH1A1 (0.55) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL3205274 0.84 ALDH1A1 (0.54) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL8536343 0.83 ALDH1A1 (0.61) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL2973727 0.83 KMT2A (0.59) ALDH1A1TDP1CYP3A4ALOX15KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6127572-A Process for preparing 2-carboxy-5-nitrobenzenesulfonic acid and salts thereof by oxidation HOECHST SCHERING AGREVO GMBH (DE) 2000-10-03 US disclosed
US-4229584-A Ureylenebis(anionic substituted phenylene carbonyl)imino naphthalene sulfonic acids and naphthalene carboxylic acids and their salts AMERICAN CYANAMID COMPANY (US) 1980-10-21 US disclosed
US-4177209-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1979-12-04 US disclosed
US-4129590-A INHIBITORS OF THE COMPLEMENT SYSTEM AMERICAN CYANAMID COMPANY (US) 1978-12-12 US disclosed