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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 known ✓ | P35354 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 4/20 | 0.44 |
| ▸ | CA1 | P00915 | 4/20 | 0.44 |
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | CA7 | P43166 | 4/20 | 0.44 |
| ▸ | CA9 | Q16790 | 4/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | DBH | P09172 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | TOP1 | P11387 | 3/20 | 0.39 |
| ▸ | SNCA | P37840 | 2/20 | 0.37 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28257502 | 0.83 | CA12 (0.47) | CA12CA1CA2CA7CA9 | |
| Potassium Ion SCHEMBL9820487 | 0.75 | ALDH1A1 (0.40) | CA12CA1CA2CA7CA9 | |
| SCHEMBL23067459 | 0.73 | CA12 (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL29556771 | 0.73 | CA12 (0.52) | CA12CA1CA2CA7CA9 | |
| Potassium Ion SCHEMBL9365529 | 0.71 | HDAC6 (0.55) | CA12CA1CA2CA7CA9 | |
| SCHEMBL9131982 | 0.69 | CA12 (0.56) | CA12CA1CA2CA7CA9 | |
| Hydrochloric Acid SCHEMBL10692931 | 0.68 | CA12 (0.41) | CA12CA1CA2CA7CA9 | |
| Hydrochloric Acid SCHEMBL10689431 | 0.67 | KDM4E (0.41) | CA12CA1CA2CA7CA9 | |
| Protocatechuamide SCHEMBL1128716 | 0.65 | LCK (0.65) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5092572 | 0.65 | CA12 (0.50) | CA12CA1CA2CA7CA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5412093-A | 3-heterocyclic thiomethyl cephalosporins | ICI PHARMA (FR) | 1995-05-02 | — | — | US | disclosed |
| US-5262410-A | Antibiotics | ICI PHARMA (FR) | 1993-11-16 | — | — | US | disclosed |
| US-5057511-A | Antibiotics, bactericides | ICI PHARMA (GB) | 1991-10-15 | — | — | US | disclosed |
| EP-0272827-A2 | 3-Heterocyclicthiomethyl cephalosphorins | ZENECA Pharma S.A. (FR) | 1988-06-29 | — | — | EP | disclosed |