Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.61 |
| ▸ | CES1 | P23141 | 2/20 | 0.61 |
| ▸ | PARP1 | P09874 | 1/20 | 0.57 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5649611 | 0.83 | CES2 (0.65) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL30954391 | 0.83 | PARP1 (0.67) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL26929368 | 0.83 | PARP1 (0.67) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL6972626 | 0.81 | CES2 (0.56) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL5580386 | 0.80 | CES2 (0.61) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL2410692 | 0.80 | CES2 (0.61) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL29570653 | 0.80 | KMT2A (0.69) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL2141235 | 0.80 | PARP1 (0.62) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL17070601 | 0.80 | KMT2A (0.69) | CES2CES1PARP1ESR1ESR2 | |
| SCHEMBL1056526 | 0.80 | KMT2A (0.69) | CES2CES1PARP1ESR1ESR2 |
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-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |