Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | RAB9A | P51151 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28767972 | 0.80 | HSD17B10 (0.39) | LMNAKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL18040333 | 0.79 | KIF11 (0.45) | NPC1RAB9ASMN1; SMN2TP53LMNA | |
| SCHEMBL14495809 | 0.76 | CNR2 (0.32) | NPC1RAB9ASMN1; SMN2TP53LMNA | |
| SCHEMBL14508116 | 0.76 | MAPT (0.31) | NPC1RAB9ASMN1; SMN2TP53LMNA | |
| SCHEMBL25475487 | 0.75 | KIF11 (0.39) | NPC1RAB9ASMN1; SMN2TP53LMNA | |
| SCHEMBL5058981 | 0.73 | NPC1 (0.42) | NPC1RAB9ASMN1; SMN2TP53LMNA | |
| SCHEMBL12348747 | 0.72 | AKR1C3 (0.33) | ALDH1A1 | |
| SCHEMBL27697517 | 0.71 | KIF11 (0.38) | NPC1RAB9ASMN1; SMN2TP53LMNA | |
| SCHEMBL14493024 | 0.70 | CNR2 (0.33) | NPC1RAB9ASMN1; SMN2LMNAMAPT | |
| SCHEMBL24760552 | 0.70 | SLC6A2 (0.38) | NPC1RAB9ASMN1; SMN2TP53KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-109879870-B | Synthesis and application of novel functional material based on benzothiadiazole | 常州大学 | 2022-06-28 | — | — | CN | disclosed |