Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CLK1 | P49759 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4724370 | 0.93 | SMN1; SMN2 (0.46) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL14543177 | 0.87 | SMN1; SMN2 (0.53) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2306186 | 0.79 | SMN1; SMN2 (0.42) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL6615315 | 0.78 | MEN1 (0.48) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL30493129 | 0.76 | KDM4E (0.42) | ALDH1A1NPC1RAB9AKDM4EMEN1 | |
| SCHEMBL30014669 | 0.75 | SMN1; SMN2 (0.46) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2305992 | 0.75 | SMN1; SMN2 (0.46) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL4767274 | 0.73 | ABCC8 (0.48) | ALDH1A1CYP3A4RAB9AAPPKDM4E | |
| SCHEMBL6618095 | 0.73 | NPC1 (0.46) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL6617025 | 0.72 | ALDH1A1 (0.39) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A |
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-2023066377-A1 | NITROGEN-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 索智生物科技（浙江）有限公司 | 2023-04-27 | — | — | WO | disclosed |