Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.55 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.55 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.49 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28622693 | 0.88 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2KDM4EPOLB | |
| SCHEMBL28630911 | 0.82 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2KDM4EPOLB | |
| SCHEMBL28630208 | 0.80 | NPC1 (0.61) | NPC1RAB9ASMN1; SMN2KDM4EPOLB | |
| SCHEMBL3651719 | 0.76 | HDAC1 (0.62) | HDAC1 | |
| SCHEMBL30041010 | 0.75 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2KDM4EPOLB | |
| SCHEMBL13341897 | 0.75 | GABRB2 (0.62) | NPC1RAB9ASMN1; SMN2KDM4EPOLB | |
| SCHEMBL3504086 | 0.74 | HDAC1 (0.90) | HDAC1 | |
| SCHEMBL3504088 | 0.74 | HDAC1 (0.90) | HDAC1 | |
| SCHEMBL28615473 | 0.74 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2KDM4EPOLB | |
| SCHEMBL15158451 | 0.73 | SLC2A1 (0.54) | NPC1RAB9ASMN1; SMN2KDM4EPOLB |
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-113372346-B | Synthetic method of 3-fatty amine methyl imidazo [1, 2-alpha ] pyridine compound | 南华大学 | 2022-08-19 | — | — | CN | disclosed |
| CN-113372346-A | Synthetic method of 3-fatty amine methyl imidazo [1, 2-alpha ] pyridine compound | 南华大学 | 2021-09-10 | — | — | CN | disclosed |