Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.59 |
| ▸ | NPC1 | O15118 | 10/20 | 0.55 |
| ▸ | RAB9A | P51151 | 10/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | HPGD | P15428 | 7/20 | 0.54 |
| ▸ | TP53 | P04637 | 3/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13183733 | 0.85 | HSD17B10 (0.55) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL12304277 | 0.83 | HSD17B10 (0.63) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL13183738 | 0.80 | HSD17B10 (0.59) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL13928214 | 0.78 | NPC1 (0.58) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL13183729 | 0.78 | HSD17B10 (0.56) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL12408905 | 0.77 | NPC1 (0.84) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL13183556 | 0.77 | HSD17B10 (0.52) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL11551873 | 0.76 | NPC1 (0.81) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL13183525 | 0.75 | HSD17B10 (0.50) | HSD17B10NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL436386 | 0.73 | NPC1 (0.76) | HSD17B10NPC1RAB9AKDM4ESMN1; 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 |
|---|---|---|---|---|---|---|---|
| US-8420686-B2 | Linked diimidazole antivirals | ENANTA PHARMACEUTICALS, INC. (US) | 2013-04-16 | — | — | US | disclosed |