Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25108287 | 0.88 | TAS1R3 (0.43) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL595365 | 0.82 | CES2 (0.53) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13171953 | 0.81 | LMNA (0.41) | RAB9AALDH1A1KDM4ELMNAHDAC1 | |
| SCHEMBL2576355 | 0.80 | RAB9A (0.47) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14747772 | 0.79 | MAPT (0.44) | CES2CES1SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL11469358 | 0.79 | NPC1 (0.41) | NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL5057415 | 0.76 | ALDH1A1 (0.46) | CES2CES1ALDH1A1KDM4EMAPT | |
| SCHEMBL25107659 | 0.76 | TPMT (0.45) | RAB9ASMN1; SMN2ALDH1A1HCAR1MEN1 | |
| SCHEMBL4020790 | 0.76 | CES2 (0.52) | CES2HDAC3HDAC8HDAC6MAPT | |
| SCHEMBL8893830 | 0.76 | CES2 (0.52) | CES2CES1SLC6A3RAB9ALMNA |
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-5670531-A | ENKEPHALINASE OR ANGIOTENSIN CONVERTING ENZYME INHIBITORS | SOCIETE CIVILE BIOPROJET (FR) | 1997-09-23 | — | — | US | disclosed |