Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | METAP2 | P50579 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5517057 | 0.93 | SLC6A3 (0.59) | SLC6A4SLC6A3L3MBTL1TDP1KDM4E | |
| Acetic Acid SCHEMBL28296133 | 0.83 | TDP1 (0.46) | SLC6A4SLC6A3L3MBTL1TDP1SMN1; SMN2 | |
| SCHEMBL5516950 | 0.83 | ALDH1A1 (0.52) | SLC6A4SLC6A3L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL698991 | 0.80 | L3MBTL1 (0.55) | L3MBTL1TDP1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL9301522 | 0.79 | SLC6A3 (0.57) | SLC6A4SLC6A3L3MBTL1KMT2AMETAP2 | |
| SCHEMBL30499558 | 0.79 | SLC6A4 (0.59) | SLC6A4SLC6A3L3MBTL1KDM4ESMN1; SMN2 | |
| SCHEMBL22290184 | 0.79 | SLC6A4 (0.59) | SLC6A4SLC6A3L3MBTL1KDM4ESMN1; SMN2 | |
| SCHEMBL28865711 | 0.79 | L3MBTL1 (0.51) | SLC6A4SLC6A3L3MBTL1TDP1KDM4E | |
| SCHEMBL28250388 | 0.78 | L3MBTL1 (0.50) | SLC6A4SLC6A3L3MBTL1TDP1KDM4E | |
| SCHEMBL69177 | 0.78 | L3MBTL1 (0.64) | L3MBTL1TDP1KDM4EALDH1A1PKM |
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-1162196-A1 | FUSED-RING COMPOUNDS AND USE THEREOF AS DRUGS | JAPAN TOBACCO INC. (JP) | 2001-12-12 | — | — | EP | disclosed |