Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10453226 | 0.85 | FFAR1 (0.45) | MAPTLMNANPSR1HTR2ASLC6A4 | |
| SCHEMBL10453420 | 0.84 | NPC1 (0.38) | NPC1RAB9AMAPTMAPK14S1PR1 | |
| SCHEMBL7858276 | 0.82 | S1PR1 (0.40) | NPC1RAB9AMAPTS1PR1S1PR3 | |
| SCHEMBL10452432 | 0.78 | MAPK14 (0.43) | NPC1RAB9AMAPTMAOAMAOB | |
| SCHEMBL7862612 | 0.78 | ESR2 (0.44) | NPC1RAB9AMAOBLMNAMEN1 | |
| SCHEMBL9833601 | 0.74 | KMT2A (0.47) | MAPTHTTMEN1KMT2ACYP3A4 | |
| SCHEMBL21501229 | 0.71 | MAOA (0.44) | MAOAMAOBMAPK14S1PR1S1PR3 | |
| SCHEMBL9836602 | 0.70 | TDP1 (0.43) | NPC1RAB9AMAPTLMNAHTT | |
| Ethylene Glycol SCHEMBL11585117 | 0.69 | MAOA (0.58) | MAOAMAOBMAPK14LMNAMMP1 | |
| SCHEMBL11480978 | 0.69 | MEN1 (0.39) | NPC1RAB9AMAPTMAOAMAOB |
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-4945100-A | Process for the preparation of 1-triazolylethyl ether derivatives | CIBA-GEIGY CORPORATION (US) | 1990-07-31 | — | — | US | disclosed |