Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL31031129 | 0.80 | ESR1 (0.63) | ESR1ESR2TTRCA2ALOX15B | |
| SCHEMBL18983645 | 0.80 | ESR1 (0.63) | ESR1ESR2TTRCA2ALOX15B | |
| SCHEMBL25082619 | 0.79 | ACHE (0.41) | ESR1ESR2TTRRIPK1AKR1B1 | |
| SCHEMBL8354476 | 0.79 | ACHE (0.41) | ESR1ESR2TTRRIPK1AKR1B1 | |
| SCHEMBL13977477 | 0.79 | MAP3K14 (0.44) | ESR1ESR2TTRCYP19A1CA2 | |
| SCHEMBL24214986 | 0.78 | LTB4R (0.40) | ESR1ESR2TTRRIPK1AKR1B1 | |
| SCHEMBL30292064 | 0.77 | HDAC1 (0.44) | ESR1ESR2RIPK1AKR1B1HDAC1 | |
| SCHEMBL22165402 | 0.77 | HDAC1 (0.44) | ESR1ESR2RIPK1AKR1B1HDAC1 | |
| SCHEMBL27883209 | 0.77 | HDAC1 (0.44) | ESR1ESR2RIPK1AKR1B1HDAC1 | |
| SCHEMBL23558482 | 0.75 | LTB4R (0.40) | ESR1ESR2TTRHDAC1HDAC2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2509950-A1 | 5-AMINO- 4-HYDROXYPENTOYL AMIDES | Janssen R&D Ireland (IE) | 2012-10-17 | — | — | EP | disclosed |
| WO-2011070131-A1 | 5-AMINO- 4-HYDROXYPENTOYL AMIDES | TIBOTEC PHARMACEUTICALS (IE) | 2011-06-16 | — | — | WO | disclosed |