Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.69 |
| ▸ | MAPT | P10636 | 3/20 | 0.69 |
| ▸ | RAB9A | P51151 | 3/20 | 0.69 |
| ▸ | POLB | P06746 | 1/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.69 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.54 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.52 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.52 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.52 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.52 |
| ▸ | PLK1 | P53350 | 1/20 | 0.51 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL18766371 | 0.91 | NPC1 (0.56) | NPC1MAPTRAB9APOLBSMN1; SMN2 | |
| SCHEMBL6444620 | 0.86 | MAPT (0.57) | NPC1MAPTRAB9APOLBSMN1; SMN2 | |
| SCHEMBL1367365 | 0.86 | PARP10 (0.70) | NPC1RAB9APARP10PLK1PLA2G4B | |
| 1-Allyloxy-4-Ethoxybenzene SCHEMBL2846327 | 0.86 | NQO1 (0.64) | NPC1MAPTRAB9APOLBSMN1; SMN2 | |
| SCHEMBL2666728 | 0.82 | NPC1 (0.56) | NPC1MAPTRAB9APOLBSMN1; SMN2 | |
| SCHEMBL1515794 | 0.82 | MAPT (0.59) | NPC1MAPTRAB9APOLBSMN1; SMN2 | |
| SCHEMBL5919048 | 0.81 | KDM4E (0.60) | NPC1MAPTRAB9APOLBSMN1; SMN2 | |
| SCHEMBL1092083 | 0.81 | L3MBTL1 (0.61) | NPC1MAPTRAB9APOLBSMN1; SMN2 | |
| SCHEMBL826744 | 0.80 | NPC1 (0.56) | NPC1MAPTRAB9APOLBSMN1; SMN2 | |
| SCHEMBL8332709 | 0.79 | MAPT (0.56) | NPC1MAPTRAB9APOLBSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017067634-A1 | BENZIL MONOKETALAND USE THEREOF | MERCK PATENT GMBH (DE) | 2017-04-27 | — | — | WO | disclosed |