Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.57 |
| ▸ | CES1 | P23141 | 2/20 | 0.57 |
| ▸ | PARP1 | P09874 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.45 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10367778 | 0.85 | CES2 (0.57) | CES2CES1PARP1HDAC1HDAC6 | |
| SCHEMBL27746164 | 0.81 | CES2 (0.52) | CES2CES1PARP1HDAC1HDAC6 | |
| SCHEMBL8894640 | 0.80 | CES2 (0.50) | CES2CES1PARP1AKR1C3AKR1C2 | |
| SCHEMBL16324265 | 0.78 | AKR1C3 (0.60) | PARP1AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL367696 | 0.78 | AKR1C1 (0.61) | CES2CES1PARP1AKR1C3AKR1C2 | |
| SCHEMBL2555171 | 0.78 | AKR1C1 (0.61) | CES2CES1PARP1AKR1C3AKR1C2 | |
| SCHEMBL1996918 | 0.78 | AKR1C1 (0.61) | CES2CES1PARP1AKR1C3AKR1C2 | |
| SCHEMBL2090707 | 0.76 | CES2 (0.54) | CES2CES1PARP1HDAC1HDAC6 | |
| SCHEMBL15180847 | 0.76 | CES2 (0.79) | CES2CES1PARP1HDAC1HDAC6 | |
| Methyl Alcohol SCHEMBL27893546 | 0.76 | CES2 (0.65) | CES2CES1PARP1HDAC1HDAC6 |
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 |