Potassium Ion

Potassium Ion

SCHEMBL11244388

CN(NC(=O)c1ccccc1C(=O)[O-])C(=S)Nc1ccccc1.[K+]

nearest known ligand 0.44

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Known targets — ChEMBL curated mechanism

AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA

The experimentally established mechanism targets of Potassium Ion. 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
ALDH1A1 P00352 4/20 0.43
HPGD P15428 2/20 0.41
EPHX1 P07099 1/20 0.41
MASP2 O00187 1/20 0.40
LMNA P02545 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
MAPT P10636 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 2/20 0.39
RAB9A P51151 1/20 0.39
BCAT2 O15382 1/20 0.38
CYP1A2 P05177 1/20 0.37
ALPL P05186 1/20 0.37

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
SCHEMBL11067057 0.87 ALDH1A1 (0.58) ALDH1A1HPGDEPHX1MASP2MEN1
SCHEMBL11244383 0.86 ALDH1A1 (0.57) ALDH1A1HPGDEPHX1MASP2MEN1
Ammonia Solution, Strong SCHEMBL11230292 0.86 ALDH1A1 (0.57) ALDH1A1HPGDEPHX1MASP2MEN1
Ammonia Solution, Strong SCHEMBL11230287 0.86 ALDH1A1 (0.57) ALDH1A1HPGDEPHX1MASP2MEN1
SCHEMBL11063673 0.85 MASP2 (0.44) ALDH1A1HPGDEPHX1MASP2LMNA
SCHEMBL11063142 0.84 KMT2A (0.47) ALDH1A1HPGDEPHX1LMNAMAPT
SCHEMBL11074428 0.80 ALDH1A1 (0.47) ALDH1A1HPGDLMNATDP1MAPT
SCHEMBL11401008 0.79 ALDH1A1 (0.55) ALDH1A1EPHX1MASP2LMNAMAPT
SCHEMBL11236170 0.79 LMNA (0.48) ALDH1A1HPGDEPHX1MASP2LMNA
SCHEMBL11185293 0.77 ALDH1A1 (0.45) ALDH1A1HPGDLMNATDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0009324-B1 SUBSTITUTED 1-BENZOYL-3-THIOSEMICARBAZIDES, THEIR MANUFACTURE AND USE AS PLANT GROWTH REGULANTS, AND AGRICULTURAL FORMULATIONS COMPRISING THEM Gulf Oil Corporation (US) 1982-07-21 EP disclosed