Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | DDR1 | Q08345 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | F7 | P08709 | 2/20 | 0.32 |
| ▸ | F3 | P13726 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28841248 | 0.84 | ALDH1A1 (0.44) | ALDH1A1KDM4EPOLBSMN1; SMN2PKM | |
| SCHEMBL28841380 | 0.84 | F7 (0.37) | DDR1F7F3 | |
| SCHEMBL28841333 | 0.83 | DDR1 (0.40) | ALDH1A1KDM4EPOLBSMN1; SMN2DDR1 | |
| SCHEMBL28841229 | 0.70 | ALDH1A1 (0.43) | ALDH1A1KDM4EPOLBSMN1; SMN2PKM | |
| SCHEMBL28841322 | 0.70 | ALDH1A1 (0.48) | ALDH1A1KDM4EPOLBSMN1; SMN2PKM | |
| SCHEMBL29878650 | 0.70 | ALDH1A1 (0.43) | ALDH1A1KDM4EPOLBSMN1; SMN2PKM | |
| SCHEMBL20144323 | 0.70 | POLB (0.32) | KDM4EPOLBSMN1; SMN2NPSR1 | |
| SCHEMBL19327406 | 0.69 | UTRN (0.39) | ALDH1A1KDM4ESMN1; SMN2KMT2AMAPT | |
| SCHEMBL7193264 | 0.69 | NOTUM (0.47) | ALDH1A1KDM4ESMN1; SMN2F7F3 | |
| SCHEMBL16346425 | 0.69 | UTRN (0.34) | POLB |
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-110452234-B | Schiff base derivative containing trifluoromethyl pyridine dicarboxamide and application thereof | 贵州大学 | 2022-09-23 | — | — | CN | disclosed |