Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | PTGES | O14684 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL543147 | 0.83 | TSHR (0.39) | TSHRJAK1ALDH1A1 | |
| SCHEMBL543523 | 0.77 | FFAR4 (0.38) | FFAR1TSHRNR4A2RXRARXRB | |
| SCHEMBL543137 | 0.76 | HTR2A (0.35) | JAK1 | |
| SCHEMBL543772 | 0.75 | MTNR1B (0.46) | — | |
| SCHEMBL3423257 | 0.71 | FFAR1 (0.52) | FFAR1NR4A2RXRARXRBRXRG | |
| SCHEMBL14892502 | 0.71 | FFAR1 (0.52) | FFAR1NR4A2RXRARXRBRXRG | |
| SCHEMBL31076279 | 0.69 | FFAR4 (0.41) | FFAR1NR4A2RXRARXRBRXRG | |
| SCHEMBL3419095 | 0.68 | HTR2C (0.49) | FFAR1PTGS2PTGES | |
| SCHEMBL14007017 | 0.68 | JAK2 (0.47) | TSHRJAK2ALDH1A1HPGD | |
| SCHEMBL2778475 | 0.68 | NFKB1 (0.41) | DHODHPARP1ALDH1A1HPGD |
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-2141150-A1 | BICYCLIC COMPOUND AND PHARMACEUTICAL USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-01-06 | — | — | EP | disclosed |