Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 11/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 11/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.43 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1679159 | 0.90 | AKR1C3 (0.49) | AKR1C3AKR1C2NR1H2NR1H3AKR1C4 | |
| SCHEMBL1679283 | 0.86 | NR1H2 (0.51) | AKR1C3AKR1C2NR1H2NR1H3AKR1C4 | |
| SCHEMBL1679052 | 0.85 | NR1H2 (0.62) | AKR1C3AKR1C2NR1H2NR1H3AKR1C4 | |
| SCHEMBL4938650 | 0.84 | NR1H2 (0.58) | NR1H2NR1H3FFAR1RXRA | |
| SCHEMBL1679697 | 0.79 | NR1H2 (0.63) | AKR1C3AKR1C2NR1H2NR1H3AKR1C4 | |
| SCHEMBL4944371 | 0.78 | NR1H2 (0.53) | NR1H2NR1H3FFAR1RXRA | |
| SCHEMBL1679269 | 0.78 | NR1H2 (0.61) | AKR1C3AKR1C2NR1H2NR1H3AKR1C4 | |
| SCHEMBL1678560 | 0.77 | NR1H2 (0.60) | AKR1C3AKR1C2NR1H2NR1H3AKR1C4 | |
| SCHEMBL1678042 | 0.77 | NR1H2 (0.60) | AKR1C3AKR1C2NR1H2NR1H3AKR1C4 | |
| SCHEMBL1678564 | 0.76 | NR1H2 (0.61) | AKR1C3AKR1C2NR1H2NR1H3AKR1C4 |
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-7923573-B2 | Benzene compound having 2 or more substituents | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2011-04-12 | — | — | US | disclosed |