Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 3/20 | 0.65 |
| ▸ | NPC1 | O15118 | 4/20 | 0.63 |
| ▸ | RAB9A | P51151 | 3/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | P4HA1 | P13674 | 3/20 | 0.59 |
| ▸ | P4HTM | Q9NXG6 | 2/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.56 |
| ▸ | RELA | Q04206 | 1/20 | 0.56 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.48 |
| ▸ | HPGDS | O60760 | 1/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.45 |
| ▸ | ADH5 | P11766 | 1/20 | 0.45 |
| ▸ | MIF | P14174 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3169338 | 0.87 | NPC1 (0.51) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL8521766 | 0.86 | LDHA (0.85) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL5592910 | 0.85 | LDHA (0.67) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL30753641 | 0.84 | LDHA (0.81) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL28312333 | 0.84 | LDHA (0.81) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL5648046 | 0.81 | LDHA (0.71) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL28060317 | 0.80 | LDHA (0.73) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL505455 | 0.79 | LDHA (1.00) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL24975547 | 0.78 | LDHA (0.71) | LDHANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL2947695 | 0.78 | NPC1 (0.75) | LDHANPC1RAB9ASMN1; SMN2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025080049-A1 | COMPOUND FOR INHIBITING ATX, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR USE IN PREVENTING OR TREATING ATX ACTIVITY-RELATED DISEASES CONTAINING SAME AS ACTIVE INGREDIENT | 한국화학연구원 | 2025-04-17 | — | — | WO | disclosed |