Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.55 |
| ▸ | XDH | P47989 | 1/20 | 0.55 |
| ▸ | F11 | P03951 | 1/20 | 0.48 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.48 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HPGDS | O60760 | 1/20 | 0.46 |
| ▸ | FNTA | P49354 | 1/20 | 0.46 |
| ▸ | FNTB | P49356 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31223807 | 1.00 | SLC22A12 (0.55) | SLC22A12XDHF11PIN1NOTUM | |
| SCHEMBL15886305 | 0.79 | CLK4 (0.45) | F11PIN1NOTUMHPGDSPTPN5 | |
| SCHEMBL19189400 | 0.78 | PRF1 (0.45) | NOTUMHPGDSPRF1 | |
| SCHEMBL31223777 | 0.76 | PTPN1 (0.56) | PIN1NOTUMMEN1ALDH1A1GAA | |
| SCHEMBL28626834 | 0.76 | PTPN1 (0.56) | PIN1NOTUMMEN1ALDH1A1GAA | |
| SCHEMBL24951797 | 0.76 | ALDH1A1 (0.55) | XDHPIN1NOTUMMEN1ALDH1A1 | |
| SCHEMBL29742895 | 0.76 | ALDH1A1 (0.55) | XDHPIN1NOTUMMEN1ALDH1A1 | |
| SCHEMBL20746116 | 0.75 | HPGDS (0.65) | SLC22A12XDHMEN1ALDH1A1GAA | |
| SCHEMBL17461870 | 0.74 | XDH (0.57) | SLC22A12XDHF11PIN1NOTUM | |
| SCHEMBL31181950 | 0.74 | GAA (0.54) | MEN1ALDH1A1GAAHPGDKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113444081-B | Thiadiazole carboxamide compounds and application thereof | 浙江大学 | 2022-07-05 | — | — | CN | disclosed |
| CN-113444081-A | Thiadiazole amide compound and application thereof | 浙江大学 | 2021-09-28 | — | — | CN | disclosed |