Potassium Ion

Potassium Ion

SCHEMBL3860004

CCC(C)Nc1cc(C(=O)[O-])cc(NCS(C)(=O)=O)n1.[K+]

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

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 11)

geneUniProtsupporting neighboursconfidence
PTGS2 known ✓ P35354 4/20 0.34
PTGS1 known ✓ P23219 1/20 0.34
HCAR3 P49019 5/20 0.39
HIPK2 Q9H2X6 2/20 0.38
GLP1R P43220 2/20 0.35
BACE1 P56817 1/20 0.34
BPTF Q12830 1/20 0.32
LRRK2 Q5S007 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
KDM4D Q6B0I6 1/20 0.30
CXCR2 P25025 2/20 0.30

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 SCHEMBL3855703 1.00 HCAR3 (0.39) HCAR3HIPK2GLP1RBACE1PTGS2
SCHEMBL3857907 0.89 HCAR3 (0.47) HCAR3HIPK2GLP1RBACE1PTGS2
SCHEMBL3853331 0.89 HCAR3 (0.47) HCAR3HIPK2GLP1RBACE1PTGS2
SCHEMBL3854392 0.85 HCAR3 (0.39) HCAR3GLP1RBACE1BPTF
Potassium Ion SCHEMBL3855706 0.79 BACE1 (0.38) HCAR3HIPK2GLP1RBACE1PTGS2
Potassium Ion SCHEMBL3855701 0.79 BACE1 (0.38) HCAR3HIPK2GLP1RBACE1PTGS2
SCHEMBL3857860 0.74 HCAR3 (0.45) HCAR3HIPK2GLP1RBACE1HCAR2
SCHEMBL3856270 0.71 HCAR3 (0.38) HCAR3BACE1
SCHEMBL3854451 0.70 BACE1 (0.51) HCAR3HIPK2GLP1RBACE1PTGS2
SCHEMBL3854457 0.70 BACE1 (0.51) HCAR3HIPK2GLP1RBACE1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618978-B2 Amides as BACE inhibitors ELI LILLY AND COMPANY (US) 2009-11-17 US disclosed
US-7585885-B2 Pyrrolidine derivatives useful as BACE inhibitors ELI LILLY AND COMPANY (US) 2009-09-08 US disclosed
US-20070225372-A1 Amides as Bace Inhibitors ELI LILLY AND COMPANY 2007-09-27 US disclosed
US-20070213331-A1 PYRROLIDINE DERIVATIVES USEFUL AS BASE INHIBITORS ELI LILLY AND COMPANY 2007-09-13 US disclosed
EP-1740575-A2 PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS ELI LILLY AND COMPANY (US) 2007-01-10 EP disclosed
WO-2005108358-A2 PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS ELI LILLY AND COMPANY (US) 2005-11-17 WO 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 (2 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-20070225372-A1 Amides as Bace Inhibitors BACE2, BACE1, APP PTGS2 3115/4885PTGS1 2327/4885HCAR3 1734/4885
US-20070213331-A1 PYRROLIDINE DERIVATIVES USEFUL AS BASE INHIBITORS BACE1, BACE2, PSEN1 PTGS2 1985/4885PTGS1 1188/4885HCAR3 3196/4885

“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.