Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 1/20 | 0.48 |
| ▸ | CNR1 | P21554 | 5/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044209 | 0.92 | HRH3 (0.43) | CNR1HRH3TSHRNR1H4ALDH1A1 | |
| SCHEMBL4038094 | 0.87 | TSHR (0.45) | CNR1CNR2HRH3TSHRALDH1A1 | |
| SCHEMBL4038040 | 0.85 | TSHR (0.38) | CNR1HRH3TSHRALDH1A1MEN1 | |
| SCHEMBL4040060 | 0.85 | LMNA (0.48) | CNR1CNR2HRH3TSHRALDH1A1 | |
| SCHEMBL4043896 | 0.84 | HTT (0.42) | MDM2TDP1TRPV1TSHRALDH1A1 | |
| SCHEMBL4038946 | 0.83 | OPRL1 (0.41) | CNR1CNR2HRH3TSHRMEN1 | |
| SCHEMBL4042732 | 0.82 | NR1H4 (0.44) | MDM2HRH3TSHRNR1H4ALDH1A1 | |
| SCHEMBL4039101 | 0.82 | NR1H4 (0.44) | MDM2HRH3TSHRNR1H4ALDH1A1 | |
| SCHEMBL4045309 | 0.81 | TRPV1 (0.41) | MDM2HRH3TDP1TRPV1MEN1 | |
| SCHEMBL4040480 | 0.80 | NR1H4 (0.44) | HRH3NR1H4ALDH1A1EPHX1LMNA |
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-2038259-A1 | BENZIMIDAZOLE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, THEIR USE AS FXR AGONISTS AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME | F.HOFFMANN-LA ROCHE AG (CH) | 2009-03-25 | — | — | EP | disclosed |
| WO-2008000643-A1 | BENZIMIDAZOLE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, THEIR USE AS FXR AGONISTS AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME | F. HOFFMANN-LA ROCHE AG (CH) | 2008-01-03 | — | — | WO | disclosed |