Potassium Ion

Potassium Ion

SCHEMBL7863712

CCc1ccc(C(CCN2CCN(c3ccccc3OC)CC2)Oc2ccc(C(=O)c3cn(CCCC(=O)[O-])c4ccccc34)cc2)cc1.[K+]

nearest known ligand 0.61

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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 6)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 6/20 0.56
ADRA1A P35348 6/20 0.56
ADRA1B P35368 6/20 0.56
HTR1A P08908 2/20 0.50
SRD5A1 P18405 3/20 0.49
SRD5A2 P31213 3/20 0.49

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
Potassium Ion SCHEMBL7860713 0.95 HTR1A (0.57) ADRA1DADRA1AADRA1BHTR1A
Potassium Ion SCHEMBL7860745 0.93 ADRA1D (0.55) ADRA1DADRA1AADRA1BHTR1A
Potassium Ion SCHEMBL7860366 0.93 ADRA1D (0.55) ADRA1DADRA1AADRA1BHTR1A
Potassium Ion SCHEMBL7853719 0.93 ADRA1D (0.55) ADRA1DADRA1AADRA1BHTR1A
SCHEMBL7859368 0.88 ADRA1D (0.62) ADRA1DADRA1AADRA1BHTR1A
Potassium Ion SCHEMBL7860833 0.87 ADRA1D (0.48) ADRA1DADRA1AADRA1BHTR1ASRD5A1
Potassium Ion SCHEMBL7859138 0.87 ADRA1D (0.49) ADRA1DADRA1AADRA1BHTR1A
SCHEMBL12013917 0.86 ADRA1D (0.64) ADRA1DADRA1AADRA1B
SCHEMBL7854220 0.86 ADRA1D (0.55) ADRA1DADRA1AADRA1BHTR1A
Potassium Ion SCHEMBL7860386 0.86 ADRA1D (0.50) ADRA1DADRA1AADRA1BSRD5A1SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0753511-B1 4-INDOL-1-YL BUTYRIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF ALPHA1-ADRENERGIC RECEPTORS AND TESTOSTERONE 5ALPHA-REDUCTASES ZERIA PHARM CO LTD (JP) 2001-07-11 EP disclosed
US-5760040-A THERAPEUTIC AGENT FOR PROSTATIC HYPERTROPHY, URINATION DISORDER, ALOPECIA AND ACNE ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-06-02 US disclosed
EP-0753511-A1 INDOLE DERIVATIVE AND MEDICINE CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1997-01-15 EP disclosed