Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.35 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 3/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | PIEZO1 | Q92508 | 1/20 | 0.33 |
| ▸ | PORCN | Q9H237 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10855707 | 0.73 | KDR (0.46) | KDRCYP1A2KDM4EALDH1A1CDC7 | |
| SCHEMBL16640385 | 0.72 | HTT (0.56) | HTTRECQLCYP1A2KDM4EALDH1A1 | |
| SCHEMBL7864083 | 0.72 | HTT (0.44) | HTTRECQLCYP1A2KDM4EALDH1A1 | |
| SCHEMBL2560793 | 0.69 | KDR (0.38) | KDR | |
| SCHEMBL15881584 | 0.68 | ALDH1A1 (0.43) | HTTRECQLCYP1A2KDM4EALDH1A1 | |
| SCHEMBL13801156 | 0.67 | HTT (0.59) | HTTRECQLCYP1A2KDM4EALDH1A1 | |
| SCHEMBL12571417 | 0.67 | ALDH1A1 (0.46) | HTTRECQLTSHRCYP1A2KDM4E | |
| Cyanate SCHEMBL14053752 | 0.66 | PIM1 (0.40) | HTTRECQLCYP1A2KDM4EALDH1A1 | |
| SCHEMBL29598957 | 0.66 | NISCH (0.50) | HTTRECQLTSHRCYP1A2KDM4E | |
| SCHEMBL78566 | 0.66 | NISCH (0.50) | HTTRECQLTSHRCYP1A2KDM4E |
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-117561252-A | 2- [3- [1[ (quinazolin-4-yl) amino ] ethyl ] pyrazin-2-yl ] thiazole-5-carbonitrile derivatives and similar compounds as pesticides | 先正达农作物保护股份公司 | 2024-02-13 | — | — | CN | disclosed |
| CN-117561252-A | 2- [3- [1[ (quinazolin-4-yl) amino ] ethyl ] pyrazin-2-yl ] thiazole-5-carbonitrile derivatives and similar compounds as pesticides | 先正达农作物保护股份公司 | 2024-02-13 | — | — | CN | disclosed |