Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.40 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2781437 | 0.89 | ALDH1A1 (0.63) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL27517470 | 0.87 | ALDH1A1 (0.61) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| SCHEMBL27583970 | 0.79 | NPC1 (0.54) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| SCHEMBL2090319 | 0.79 | NPSR1 (0.54) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| SCHEMBL21800135 | 0.79 | ALDH1A1 (0.52) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| SCHEMBL2203788 | 0.79 | KMT2A (0.52) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| SCHEMBL22946391 | 0.78 | NPC1 (0.47) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| SCHEMBL9345905 | 0.78 | ALDH1A1 (0.47) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| SCHEMBL28937821 | 0.78 | TP53 (0.44) | ALDH1A1HTTNPSR1NPC1RAB9A | |
| SCHEMBL2090317 | 0.77 | NPSR1 (0.52) | ALDH1A1HTTNPSR1NPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113336665-B | Preparation method of bromobenzene para-aminated compound mediated by high-valence iodine reagent | 湖北工业大学 | 2022-11-29 | — | — | CN | disclosed |
| CN-113336665-A | Preparation method of bromobenzene para-aminated compound mediated by high-valence iodine reagent | 湖北工业大学 | 2021-09-03 | — | — | CN | disclosed |