Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31361712 | 0.84 | DRD4 (0.41) | ALDH1A1DRD4L3MBTL1KMT2AMAPT | |
| SCHEMBL31361681 | 0.82 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| SCHEMBL31361652 | 0.78 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| SCHEMBL672209 | 0.75 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| SCHEMBL27028588 | 0.74 | L3MBTL1 (0.45) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| SCHEMBL15894947 | 0.72 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| SCHEMBL31361640 | 0.71 | MAPT (0.42) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| SCHEMBL16652728 | 0.71 | MAPT (0.42) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| SCHEMBL31361644 | 0.71 | MAPT (0.42) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| SCHEMBL16652730 | 0.71 | MAPT (0.42) | ALDH1A1L3MBTL1KMT2AMAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-9745320-B2 | Five-and-six-membered heterocyclic compound, and preparation method, pharmaceutical composition and use thereof | GUANGZHOU MAXINOVEL PHARMACEUTICALS CO., LTD. (CN) | 2017-08-29 | — | — | US | disclosed |