Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | PRSS12 | P56730 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | G6PD | P11413 | 1/20 | 0.32 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL28544082 | 0.83 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2HTTKMT2ACYP1A2 | |
| SCHEMBL22380 | 0.77 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2HTTKMT2AMEN1 | |
| SCHEMBL29395460 | 0.77 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2HTTKMT2AMEN1 | |
| SCHEMBL30430210 | 0.76 | KDM4E (0.50) | ALDH1A1SMN1; SMN2KMT2AMEN1NPC1 | |
| SCHEMBL4632412 | 0.76 | KDM4E (0.50) | ALDH1A1SMN1; SMN2KMT2AMEN1NPC1 | |
| SCHEMBL3215357 | 0.76 | HDAC3 (0.50) | ALDH1A1SMN1; SMN2HTTKMT2AMEN1 | |
| SCHEMBL14302077 | 0.76 | HDAC1 (0.52) | ALDH1A1HTTUSP2KMT2AMEN1 | |
| SCHEMBL28465404 | 0.75 | USP2 (0.39) | ALDH1A1SMN1; SMN2HTTUSP2KMT2A | |
| SCHEMBL28540549 | 0.73 | SMN1; SMN2 (0.54) | ALDH1A1SMN1; SMN2HTTUSP2KMT2A | |
| SCHEMBL17342166 | 0.73 | HTT (0.54) | ALDH1A1SMN1; SMN2HTTUSP2KMT2A |
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-112441990-A | Bisamide compound containing 3, 4-dichloroisothiazole heterocycle, and preparation method and application thereof | 江西天宇化工有限公司 | 2021-03-05 | — | — | CN | disclosed |