Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.58 |
| ▸ | GAA | P10253 | 4/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.55 |
| ▸ | TP53 | P04637 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.55 |
| ▸ | CACNA1F | O60840 | 3/20 | 0.55 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.55 |
| ▸ | CACNA1S | Q13698 | 3/20 | 0.55 |
| ▸ | CACNA1C | Q13936 | 3/20 | 0.55 |
| ▸ | GMNN | O75496 | 2/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL11782732 | 0.90 | NR1I2 (0.64) | NR1I2KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL11782746 | 0.88 | NR1I2 (0.59) | NR1I2KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL11782425 | 0.86 | GAA (0.73) | NR1I2KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL10961715 | 0.86 | KDM4E (0.62) | NR1I2KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL11782443 | 0.85 | GAA (0.68) | NR1I2KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL29676206 | 0.84 | NR1I2 (0.73) | NR1I2KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL3034560 | 0.84 | NR1I2 (0.73) | NR1I2KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL7390505 | 0.83 | MAPT (0.56) | KDM4EMAPTHSD17B10TSHR | |
| SCHEMBL11007706 | 0.83 | KDM4E (0.59) | NR1I2KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL7414856 | 0.82 | NR1I2 (0.67) | NR1I2KDM4EGAAMAPTHSD17B10 |
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-5378718-A | Cardiovascular activity, hypotensive | CEDONA PHARMACEUTICALS B.V. (NL) | 1995-01-03 | — | — | US | disclosed |
| WO-1992002503-A1 | NOVEL 1,4-DIHYDROPYRIDINE DERIVATIVES | CEDONA PHARMACEUTICALS BV (NL) | 1992-02-20 | — | — | WO | disclosed |