Potassium Ion

Potassium Ion

SCHEMBL7455208

CC(C)(C)[O-].CC(C)CC(C(=O)OC(C)(C)C)C(C(=O)O)C(=O)OCc1ccccc1.[K+]

nearest known ligand 0.46

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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 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
XBP1 P17861 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CTSK P43235 5/20 0.42
SYK P43405 1/20 0.40
CTSB P07858 1/20 0.39
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
GPR55 Q9Y2T6 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
SCHEMBL6622988 0.95 POLB (0.46) POLBGAAMAPTXBP1NPSR1
SCHEMBL7331165 0.95 POLB (0.46) POLBGAAMAPTXBP1NPSR1
SCHEMBL7418023 0.90 CTSK (0.47) POLBGAAMAPTXBP1NPSR1
SCHEMBL4633702 0.90 CTSK (0.47) POLBGAAMAPTXBP1NPSR1
SCHEMBL5497072 0.90 CTSK (0.47) POLBGAAMAPTXBP1NPSR1
SCHEMBL5188450 0.88 CTSK (0.47) POLBGAAMAPTXBP1NPSR1
SCHEMBL5187344 0.88 CTSK (0.47) POLBGAAMAPTXBP1NPSR1
SCHEMBL9327711 0.86 CTSK (0.48) POLBGAAMAPTXBP1NPSR1
SCHEMBL7438556 0.86 CTSK (0.46) POLBGAAMAPTXBP1NPSR1
SCHEMBL8385337 0.85 ALDH1A1 (0.49) TDP1CTSKCTSBCTSLCTSS

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-0960108-A1 MATRIX METALLOPROTEINASE INHIBITORS PHARMACIA & UPJOHN S.p.A. (IT) 1999-12-01 EP disclosed
WO-1998033788-A1 MATRIX METALLOPROTEINASE INHIBITORS PHARMACIA & UPJOHN S.P.A. (IT) 1998-08-06 WO disclosed