Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14936913 | 0.90 | GPBAR1 (0.36) | GPBAR1ALDH1A1APPCCR1KMT2A | |
| SCHEMBL14937282 | 0.89 | NAMPT (0.41) | MAPTTP53 | |
| SCHEMBL14937281 | 0.89 | NAMPT (0.41) | MAPTTP53 | |
| SCHEMBL14936640 | 0.88 | GPBAR1 (0.38) | GPBAR1ALDH1A1APPKMT2AMEN1 | |
| SCHEMBL14936642 | 0.88 | GPBAR1 (0.38) | GPBAR1ALDH1A1APPKMT2AMEN1 | |
| SCHEMBL14936453 | 0.86 | GPBAR1 (0.37) | GPBAR1ALDH1A1MAPT | |
| SCHEMBL14936454 | 0.86 | GPBAR1 (0.37) | GPBAR1ALDH1A1MAPT | |
| SCHEMBL14936987 | 0.80 | GPBAR1 (0.43) | GPBAR1ALDH1A1MAPTHPGDL3MBTL1 | |
| SCHEMBL14936985 | 0.80 | GPBAR1 (0.43) | GPBAR1ALDH1A1MAPTHPGDL3MBTL1 | |
| SCHEMBL14936672 | 0.78 | GPBAR1 (0.44) | GPBAR1ALDH1A1KMT2AMEN1 |
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-2780330-A1 | 1-PYRIDAZINYL-HYDROXYIMINO- 3- PHENYL- PROPANES AS GPBAR1 AGONISTS | F.HOFFMANN-LA ROCHE AG (CH) | 2014-09-24 | — | — | EP | disclosed |
| WO-2013072265-A1 | 1-PYRIDAZINYL-HYDROXYIMINO- 3- PHENYL- PROPANES AS GPBAR1 AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-05-23 | — | — | WO | disclosed |