Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 4/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29092869 | 0.80 | NPC1 (0.44) | MAPTLMNARAB9AMEN1NPC1 | |
| SCHEMBL29092634 | 0.80 | ALDH1A1 (0.43) | NOTUMPTGS2MAPTLMNARAB9A | |
| SCHEMBL29092087 | 0.79 | SMN1; SMN2 (0.44) | MAPTLMNAIDO1TDO2RAB9A | |
| SCHEMBL30584635 | 0.78 | IDO1 (0.49) | NOTUMMAPTLMNAIDO1TDO2 | |
| SCHEMBL29092867 | 0.78 | IDO1 (0.49) | NOTUMMAPTLMNAIDO1TDO2 | |
| SCHEMBL29092054 | 0.77 | SMN1; SMN2 (0.42) | NOTUMMAPTLMNARAB9AMEN1 | |
| SCHEMBL29092092 | 0.76 | ALDH1A1 (0.44) | PTGS2MAPTLMNARAB9AALDH1A1 | |
| SCHEMBL29092553 | 0.76 | IDO1 (0.46) | NOTUMMAPTIDO1TDO2TP53 | |
| SCHEMBL29092094 | 0.76 | MAPT (0.48) | NOTUMPTGS2MAPTRAB9AALDH1A1 | |
| SCHEMBL29092629 | 0.69 | KCNN4 (0.44) | NOTUMMEN1TP53KMT2AALDH1A1 |
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-116751172-A | Synthesis method of diiodinated 1,2, 3-triazole compound | 海南师范大学 | 2023-09-15 | — | — | CN | disclosed |