Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | DCTPP1 | Q9H773 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SMO | Q99835 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14080963 | 0.92 | NPC1 (0.43) | ALDH1A1NPBWR1MCHR1TP53NPC1 | |
| SCHEMBL11943439 | 0.91 | MAPT (0.45) | ALDH1A1NPBWR1MCHR1NPC1RAB9A | |
| SCHEMBL11943442 | 0.90 | ALDH1A1 (0.42) | ALDH1A1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL11943427 | 0.89 | ALDH1A1 (0.52) | ALDH1A1NPBWR1MCHR1NPC1RAB9A | |
| SCHEMBL17058055 | 0.88 | KMT2A (0.45) | ALDH1A1NPBWR1MCHR1NPC1RAB9A | |
| SCHEMBL11943414 | 0.88 | NPC1 (0.40) | ALDH1A1NPC1RAB9AMAPTHRH3 | |
| SCHEMBL11943351 | 0.87 | FAAH (0.49) | ALDH1A1MAPTSMN1; SMN2LMNAKMT2A | |
| SCHEMBL11943451 | 0.86 | NPC1 (0.43) | ALDH1A1MCHR1NPC1RAB9AMAPT | |
| SCHEMBL11943345 | 0.86 | NPC1 (0.43) | ALDH1A1NPBWR1MCHR1NPC1RAB9A | |
| SCHEMBL11943441 | 0.85 | ALDH1A1 (0.44) | ALDH1A1NPBWR1MCHR1MAPTHRH3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2586778-A2 | Pyridazinone derivatives useful as glucan synthase inhibitors | Merck Sharp & Dohme Corp. (US) | 2013-05-01 | — | — | EP | disclosed |
| WO-2008115381-A1 | PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | SCHERING CORPORATION (US) | 2008-09-25 | — | — | WO | disclosed |
| WO-2008115385-A2 | PIPERAZINE-SUBSTITUTED PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | SCHERING CORPORATION (US) | 2008-09-25 | — | — | WO | disclosed |