Potassium Ion

Potassium Ion

SCHEMBL28783901

COC(OC)c1cnc(C(=O)[O-])cc1C1CC1.[K+]

nearest known ligand 0.34

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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 5)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 15/20 0.34
▸ PDCD1 Q15116 3/20 0.34
▸ CD274 Q9NZQ7 3/20 0.34
▸ TRPC6 Q9Y210 2/20 0.33
▸ CNR1 P21554 1/20 0.32

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
SCHEMBL24660110 0.86 ASPH (0.40) CNR2PDCD1CD274TRPC6CNR1
SCHEMBL24660032 0.76 MAPT (0.44) CNR2TRPC6
SCHEMBL29558234 0.72 PDCD1 (0.63) PDCD1CD274
SCHEMBL24446141 0.72 PDCD1 (0.63) PDCD1CD274
SCHEMBL24446475 0.70 — —
SCHEMBL24446151 0.69 PDCD1 (0.61) PDCD1CD274
SCHEMBL30620087 0.65 SIRT6 (0.35) —
SCHEMBL22346487 0.65 SIRT6 (0.35) —
SCHEMBL21616774 0.64 GPR35 (0.43) —
SCHEMBL30340453 0.64 GPR35 (0.43) —

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
CN-113825751-A Biphenyl derivative for blocking PD-1/PD-L1 interaction and preparation method and application thereof 上海和誉生物医药科技有限公司 2021-12-21 — — CN disclosed
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