Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.47 |
| ▸ | RAB9A | P51151 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | GLA | P06280 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | CLK1 | P49759 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | NPY1R | P25929 | 1/20 | 0.46 |
| ▸ | NPY2R | P49146 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7672592 | 0.87 | NPC1 (0.46) | NPC1RAB9AMEN1KMT2AGLA | |
| SCHEMBL7672598 | 0.85 | NPC1 (0.47) | NPC1RAB9AMEN1KMT2AGLA | |
| SCHEMBL13652097 | 0.85 | NOS2 (0.51) | NPC1RAB9AMEN1KMT2AGLA | |
| SCHEMBL1488919 | 0.84 | NPC1 (0.43) | NPC1RAB9AMEN1KMT2AGLA | |
| SCHEMBL2085379 | 0.84 | NPC1 (0.43) | NPC1RAB9AMEN1KMT2AGLA | |
| SCHEMBL2441387 | 0.82 | HSD17B10 (0.58) | NPC1RAB9AMEN1KMT2AGLA | |
| SCHEMBL16959547 | 0.81 | APLNR (0.41) | HSD17B10MAPTL3MBTL1ALDH1A1POLB | |
| SCHEMBL21728056 | 0.81 | LMNA (0.43) | NPC1RAB9AMEN1KMT2AGLA | |
| SCHEMBL27279821 | 0.81 | NPC1 (0.41) | NPC1RAB9AMEN1KMT2AGLA | |
| SCHEMBL2437800 | 0.80 | NPC1 (0.55) | NPC1RAB9AMEN1KMT2AGLA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3402781-B1 | 3-((HETERO-)ARYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2020-03-04 | — | — | EP | disclosed |