Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | UBE2N | P61088 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29036205 | 0.73 | CHRNB2 (0.31) | MAPTCYP1A2KMT2A | |
| SCHEMBL6926769 | 0.70 | CREBBP (0.34) | MAPTCYP1A2KMT2A | |
| SCHEMBL28997204 | 0.68 | SMYD3 (0.38) | ALDH1A1POLBMAPTUSP2CYP1A2 | |
| SCHEMBL30350112 | 0.68 | SMYD3 (0.38) | ALDH1A1POLBMAPTUSP2CYP1A2 | |
| SCHEMBL27437424 | 0.67 | TDP1 (0.35) | ALDH1A1MAPTCYP1A2KMT2AHSD17B10 | |
| SCHEMBL27740237 | 0.67 | CMA1 (0.34) | POLBCYP1A2CYP3A4CYP2D6BLM | |
| Methylamine SCHEMBL27568812 | 0.66 | BRD4 (0.35) | MAPTCYP1A2KMT2A | |
| SCHEMBL29036195 | 0.65 | PDE3B (0.41) | ALDH1A1MAPTCYP1A2MAPK1HSD17B10 | |
| Methylamine SCHEMBL27587572 | 0.65 | KDM4E (0.33) | MAPTKMT2ATDP1 | |
| SCHEMBL29007498 | 0.64 | KDM4E (0.51) | ALDH1A1MAPTUSP2CYP1A2KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115928111-A | Method for electrochemically synthesizing 7-thiocyano-3,4-dihydroquinoxaline-2 (1H) -ketone compound | 华南理工大学 | 2023-04-07 | — | — | CN | claimed |
| CN-115928111-A | Method for electrochemically synthesizing 7-thiocyano-3,4-dihydroquinoxaline-2 (1H) -ketone compound | 华南理工大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-115928111-A | Method for electrochemically synthesizing 7-thiocyano-3,4-dihydroquinoxaline-2 (1H) -ketone compound | 华南理工大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-115928111-A | Method for electrochemically synthesizing 7-thiocyano-3,4-dihydroquinoxaline-2 (1H) -ketone compound | 华南理工大学 | 2023-04-07 | — | — | CN | disclosed |