Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ11 | Q14654 | 13/20 | 0.44 |
| ▸ | ABCC9 | O60706 | 5/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8620014 | 0.86 | KCNJ11 (0.48) | KCNJ11ABCC9P2RX7CYP3A4CYP1A2 | |
| SCHEMBL7353566 | 0.85 | KCNJ11 (0.46) | KCNJ11ABCC9P2RX7CYP3A4CYP1A2 | |
| SCHEMBL7349440 | 0.81 | ABCC9 (0.58) | KCNJ11ABCC9P2RX7CYP3A4CYP1A2 | |
| SCHEMBL7361553 | 0.80 | KCNJ11 (0.42) | KCNJ11ABCC9P2RX7 | |
| SCHEMBL8619795 | 0.80 | KCNJ11 (0.41) | KCNJ11ABCC9P2RX7CYP3A4CYP1A2 | |
| SCHEMBL7349700 | 0.77 | QPCT (0.37) | HSD17B10ALDH1A1LMNAQPCTKDM1A | |
| SCHEMBL7349695 | 0.77 | QPCT (0.37) | HSD17B10ALDH1A1LMNAQPCTKDM1A | |
| SCHEMBL7349710 | 0.77 | QPCT (0.37) | HSD17B10ALDH1A1LMNAQPCTKDM1A | |
| SCHEMBL8619737 | 0.76 | KCNJ11 (0.45) | KCNJ11ABCC9P2RX7CYP3A4CYP1A2 | |
| SCHEMBL7359994 | 0.76 | KCNJ11 (0.49) | KCNJ11ABCC9P2RX7CYP3A4CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5567722-A | DIURETICS | THE UPJOHN COMPANY (US) | 1996-10-22 | — | — | US | disclosed |
| WO-1994004500-A1 | CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS | THE UPJOHN COMPANY (US) | 1994-03-03 | — | — | WO | disclosed |