Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044495 | 1.00 | GRM5 (0.43) | GRM5NR1H4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4039126 | 1.00 | GRM5 (0.43) | GRM5NR1H4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4039906 | 0.99 | GRM5 (0.44) | GRM5NR1H4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4045000 | 0.90 | NR1H4 (0.48) | NR1H4NPC1RAB9ASMN1; SMN2CYP3A4 | |
| SCHEMBL4038480 | 0.90 | NR1H4 (0.48) | NR1H4NPC1RAB9ASMN1; SMN2CYP3A4 | |
| SCHEMBL4037444 | 0.90 | NR1H4 (0.48) | NR1H4NPC1RAB9ASMN1; SMN2CYP3A4 | |
| SCHEMBL4035053 | 0.88 | LMNA (0.44) | NR1H4NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL4041511 | 0.88 | LMNA (0.44) | NR1H4NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL4038748 | 0.88 | LMNA (0.44) | NR1H4NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL4044980 | 0.87 | LMNA (0.43) | NR1H4NPC1RAB9ASMN1; SMN2CYP1A2 |
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 |