Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.82 |
| ▸ | CES1 | P23141 | 2/20 | 0.82 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | POLB | P06746 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | RECQL | P46063 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | APEX1 | P27695 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.46 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7488645 | 0.92 | CES2 (0.69) | CES2CES1PTPN1KMT2AALDH1A1 | |
| SCHEMBL15665397 | 0.91 | CES2 (0.75) | CES2CES1PTPN1KMT2AALDH1A1 | |
| SCHEMBL2155972 | 0.91 | CES2 (1.00) | CES2CES1PTPN1KMT2AALDH1A1 | |
| SCHEMBL15233 | 0.91 | CES2 (1.00) | CES2CES1PTPN1KMT2AALDH1A1 | |
| SCHEMBL8199604 | 0.88 | CES2 (0.95) | CES2CES1PTPN1KMT2AALDH1A1 | |
| SCHEMBL11448058 | 0.88 | CES2 (0.95) | CES2CES1PTPN1KMT2AALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL11456969 | 0.88 | CES2 (0.95) | CES2CES1PTPN1KMT2AALDH1A1 | |
| SCHEMBL3068925 | 0.86 | CES2 (0.67) | CES2CES1PTPN1KMT2AALDH1A1 | |
| SCHEMBL12287695 | 0.82 | CES2 (0.67) | CES2CES1PTPN1KMT2AALDH1A1 | |
| SCHEMBL6896422 | 0.81 | CES2 (0.81) | CES2CES1PTPN1KMT2AALDH1A1 |
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-4032546-A | BIS(BENZIL) TYPE COMPOUNDS CONTAINING ONE OR TWO FURAN MOIETIES | TRW INC. (US) | 1977-06-28 | — | — | US | disclosed |