Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | CTNNB1 | P35222 | 8/20 | 0.57 |
| ▸ | WNT3A | P56704 | 8/20 | 0.57 |
| ▸ | HSD17B3 | P37058 | 6/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ABL1 | P00519 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ALPI | P09923 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | ALPG | P10696 | 1/20 | 0.52 |
| ▸ | APEX1 | P27695 | 1/20 | 0.52 |
| ▸ | CASP3 | P42574 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | CASP7 | P55210 | 1/20 | 0.52 |
| ▸ | CASP6 | P55212 | 1/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL15979730 | 0.88 | KMT2A (0.59) | NPC1RAB9ACTNNB1WNT3APOLB | |
| SCHEMBL15979719 | 0.87 | NR4A2 (0.59) | CTNNB1WNT3AALDH1A1GAATDP1 | |
| SCHEMBL30089517 | 0.85 | CTNNB1 (0.68) | NPC1RAB9ACTNNB1WNT3AL3MBTL1 | |
| SCHEMBL15979740 | 0.85 | CTNNB1 (0.68) | NPC1RAB9ACTNNB1WNT3AL3MBTL1 | |
| SCHEMBL8258872 | 0.85 | CTNNB1 (0.56) | RAB9ACTNNB1WNT3AL3MBTL1ERCC5 | |
| SCHEMBL15988752 | 0.82 | LMNA (0.64) | NPC1RAB9ACTNNB1WNT3AL3MBTL1 | |
| SCHEMBL15980079 | 0.81 | CTNNB1 (0.63) | NPC1RAB9ACTNNB1WNT3AKDM4E | |
| SCHEMBL8261221 | 0.79 | NPC1 (0.58) | NPC1RAB9AHSD17B3KDM4EALDH1A1 | |
| SCHEMBL7939950 | 0.79 | NPC1 (0.81) | NPC1RAB9AHSD17B3KDM4EALDH1A1 | |
| SCHEMBL828846 | 0.78 | KMT2A (0.62) | RAB9ACTNNB1WNT3AALDH1A1GAA |
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-7732457-B2 | Amino-pyridines as inhibitors of β-secretase | WYETH LLC (US) | 2010-06-08 | — | — | US | disclosed |