Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 3/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 5/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13178590 | 0.93 | NPC1 (0.51) | NPC1RAB9AMAPTAOC3MAOB | |
| SCHEMBL12425216 | 0.93 | NPC1 (0.51) | NPC1RAB9AMAPTAOC3MAOB | |
| SCHEMBL13892804 | 0.88 | TSHR (0.44) | ACHENPC1RAB9AMAPTCNR2 | |
| SCHEMBL8199755 | 0.85 | ACHE (0.54) | ACHENPC1RAB9AMAPTRELA | |
| SCHEMBL3436081 | 0.84 | NPC1 (0.60) | NPC1RAB9AMAPTAOC3MAOB | |
| SCHEMBL12299158 | 0.83 | NPC1 (0.43) | NPC1RAB9AMAPTAOC3MAOB | |
| SCHEMBL19958553 | 0.82 | ACHE (0.71) | ACHENPC1RAB9AMAPTRELA | |
| SCHEMBL172190 | 0.82 | ACHE (0.71) | ACHENPC1RAB9AMAPTRELA | |
| SCHEMBL10065624 | 0.82 | ACHE (0.71) | ACHENPC1RAB9AMAPTRELA | |
| SCHEMBL348291 | 0.82 | ACHE (0.71) | ACHENPC1RAB9AMAPTRELA |
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-20160225998-A1 | CHARGE-TRANSPORTING MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2016-08-04 | — | — | US | disclosed |