Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.54 |
| ▸ | BRAF | P15056 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.52 |
| ▸ | TEK | Q02763 | 1/20 | 0.51 |
| ▸ | RIOK2 | Q9BVS4 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5142340 | 0.87 | MAPT (0.58) | MAPTMEN1KMT2ANPC1POLB | |
| SCHEMBL30544168 | 0.85 | MAPT (0.61) | MAPTMEN1KMT2ANPC1POLB | |
| SCHEMBL29099852 | 0.85 | MAPT (0.61) | MAPTMEN1KMT2ANPC1POLB | |
| SCHEMBL6979591 | 0.83 | NPC1 (0.67) | MAPTMEN1KMT2ANPC1POLB | |
| SCHEMBL29099850 | 0.83 | NOTUM (0.58) | MAPTMEN1KMT2ANPC1POLB | |
| SCHEMBL29099854 | 0.83 | MEN1 (0.58) | MAPTMEN1KMT2ACSNK1DNPC1 | |
| SCHEMBL30544179 | 0.83 | MEN1 (0.58) | MAPTMEN1KMT2ACSNK1DNPC1 | |
| SCHEMBL9189502 | 0.82 | MAPT (0.72) | MAPTMEN1KMT2ANPC1POLB | |
| SCHEMBL29099856 | 0.81 | HDAC3 (0.60) | MAPTMEN1KMT2ANPC1POLB | |
| SCHEMBL30544181 | 0.81 | HDAC3 (0.60) | MAPTMEN1KMT2ANPC1POLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116715634-A | Compound, pharmaceutical composition and application thereof in preparation of vasodilation drugs | 山东第一医科大学(山东省医学科学院) | 2023-09-08 | — | — | CN | disclosed |