Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.63 |
| ▸ | VKORC1 | Q9BQB6 | 2/20 | 0.62 |
| ▸ | NQO1 | P15559 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.60 |
| ▸ | TP53 | P04637 | 2/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.59 |
| ▸ | CA2 | P00918 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5426832 | 0.86 | MAOB (0.75) | MAOBKDM4EALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL7117054 | 0.84 | MAOB (0.72) | MAOBKDM4EALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL28143005 | 0.84 | MAOB (0.72) | MAOBKDM4EALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL31511409 | 0.84 | MAOB (0.72) | MAOBKDM4EALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL7463411 | 0.84 | MAOB (0.72) | MAOBKDM4EALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL27790298 | 0.84 | MAOB (0.72) | MAOBKDM4EALDH1A1CYP3A4NQO1 | |
| SCHEMBL5141444 | 0.83 | MAOB (0.71) | MAOBKDM4EALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL11479069 | 0.83 | MAOB (0.71) | MAOBKDM4EALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL669375 | 0.83 | MAOB (0.70) | MAOBKDM4EALDH1A1CYP3A4VKORC1 | |
| SCHEMBL29466790 | 0.83 | MAOB (0.70) | MAOBKDM4EALDH1A1CYP3A4VKORC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105801544-A | 3-aryl-4-arylamine-coumarin derivative and preparing method and medical application thereof | 中国药科大学 | 2016-07-27 | — | — | CN | disclosed |
| US-4230850-A | HYPOTENSIVE AGENTS, VASODILATION | LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) | 1980-10-28 | — | — | US | disclosed |