Potassium Ion

Potassium Ion

SCHEMBL3930246

CCOC(=O)C([O-])=Cc1ccc(F)cc1[N+](=O)[O-].[K+]

nearest known ligand 0.48

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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
MAPT P10636 7/20 0.48
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
LMNA P02545 4/20 0.43
KMT2A Q03164 3/20 0.43
NPSR1 Q6W5P4 3/20 0.43
MEN1 O00255 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
FBP1 P09467 1/20 0.42
PTPN1 P18031 1/20 0.41
GLO1 Q04760 1/20 0.40
RAB9A P51151 2/20 0.39
POLB P06746 2/20 0.39
TSHR P16473 1/20 0.38
GALR2 O43603 1/20 0.38
MITF O75030 1/20 0.38
HSP90AA1 P07900 1/20 0.38

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 SCHEMBL3930244 1.00 MAPT (0.48) MAPTALDH1A1KDM4ETDP1LMNA
SCHEMBL29622732 0.88 MAPT (0.50) MAPTALDH1A1KDM4ETDP1LMNA
SCHEMBL5786539 0.86 MAPT (0.49) MAPTALDH1A1KDM4ETDP1LMNA
SCHEMBL5786549 0.86 MAPT (0.49) MAPTALDH1A1KDM4ETDP1LMNA
SCHEMBL5786542 0.86 MAPT (0.49) MAPTALDH1A1KDM4ETDP1LMNA
Potassium Ion SCHEMBL3923502 0.86 MAPT (0.50) MAPTALDH1A1TDP1KMT2ANPSR1
Potassium Ion SCHEMBL3923496 0.86 MAPT (0.50) MAPTALDH1A1TDP1KMT2ANPSR1
SCHEMBL24358978 0.78 STAT3 (0.52) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL4069118 0.77 MAPT (0.44) MAPTALDH1A1KDM4ETDP1LMNA
SCHEMBL5782741 0.74 MAPT (0.51) MAPTALDH1A1TDP1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275576-A1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO[4,5-B]INDOLE-1-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE SANOFI-AVENTIS (FR) 2009-11-05 US disclosed
US-7569567-B2 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-B]indole-1-carboxamide derivatives, their preparation and therapeutic use SANOFI-AVENTIS (FR) 2009-08-04 US disclosed
US-20080249098-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-B]indole-1-carboxamide Derivatives, Their Preparation and Therapeutic Use SANOFI-AVENTIS (FR) 2008-10-09 US disclosed
US-7402682-B2 3-heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-B]indole-1-carboxamide derivatives, their preparation and therapeutic use SANOFI-AVENTIS (FR) 2008-07-22 US disclosed
US-20060241116-A1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO[4,5-B]INDOLE-1-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE SANOFI-AVENTIS (FR) 2006-10-26 US disclosed
US-7109194-B2 3-heteroaryl-3, 5-dihydro-4-oxo-4H-pyridazino[4, 5-b]indole-1-carboxamide derivatives their preparations and therapeutic use SANOFI-AVENTIS (FR) 2006-09-19 US disclosed
US-20050096321-A1 3-heteroaryl-3, 5-dihydro-4-oxo-4H-pyridazino[4, 5-b]indole-1-carboxamide derivatives their preparations and therapeutic use SANOFI (FR) 2005-05-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060241116-A1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO[4,5-B]INDOLE-1-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE HTR3C, TPH1, IDO1 MAPT 3189/4885ALDH1A1 791/4885KDM4E 2744/4885
US-20050096321-A1 3-heteroaryl-3, 5-dihydro-4-oxo-4H-pyridazino[4, 5-b]indole-1-carboxamide derivatives their preparations and therapeutic use HTR3C, CYP3A43, IDO1 MAPT 3630/4885ALDH1A1 616/4885KDM4E 2487/4885
US-20090275576-A1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO[4,5-B]INDOLE-1-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE HTR3C, TPH1, IDO1 MAPT 3189/4885ALDH1A1 791/4885KDM4E 2744/4885
US-20080249098-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-B]indole-1-carboxamide Derivatives, Their Preparation and Therapeutic Use HTR3C, TPH1, IDO1 MAPT 3189/4885ALDH1A1 791/4885KDM4E 2744/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.