Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL19277753 | 0.83 | ALDH1A1 (0.73) | ALDH1A1RAB9ANPSR1KDM4EALOX12 | |
| SCHEMBL28638817 | 0.80 | NPC1 (0.54) | ALDH1A1RAB9ASMN1; SMN2NPC1KMT2A | |
| SCHEMBL28634224 | 0.80 | EPHX1 (0.61) | ALDH1A1RAB9ANPSR1KDM4EALOX12 | |
| SCHEMBL28645469 | 0.80 | NPC1 (0.68) | ALDH1A1RAB9ANPSR1KDM4ENPC1 | |
| SCHEMBL2306443 | 0.80 | RAB9A (0.69) | ALDH1A1RAB9ANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL29838503 | 0.80 | ALDH1A1 (0.70) | ALDH1A1RAB9ANPSR1KDM4EALOX12 | |
| SCHEMBL5449341 | 0.80 | ALDH1A1 (0.70) | ALDH1A1RAB9ANPSR1KDM4EALOX12 | |
| SCHEMBL28641153 | 0.80 | ALDH1A1 (0.64) | ALDH1A1RAB9ANPSR1KDM4EALOX12 | |
| SCHEMBL28640545 | 0.78 | ALDH1A1 (0.75) | ALDH1A1RAB9AKDM4EALOX12SMN1; SMN2 | |
| SCHEMBL11534972 | 0.77 | ALDH1A1 (0.55) | ALDH1A1RAB9ANPSR1KDM4EALOX12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113480524-A | Alkaloid hamacanthins series derivatives, and preparation method and application thereof | 河北工业大学 | 2021-10-08 | — | — | CN | claimed |
| CN-113480524-B | Alkaloid hamacanthins series derivatives, and preparation method and application thereof | 河北工业大学 | 2022-08-30 | — | — | CN | disclosed |
| CN-113480524-A | Alkaloid hamacanthins series derivatives, and preparation method and application thereof | 河北工业大学 | 2021-10-08 | — | — | CN | disclosed |