Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CHRNG | P07510 | 1/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | CHRND | Q07001 | 1/20 | 0.34 |
| ▸ | CHRNA2 | Q15822 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18388861 | 1.00 | HTT (0.36) | HTTCYP1A2CYP2C19NPC1RAB9A | |
| SCHEMBL11770393 | 0.81 | ALOX15 (0.37) | HTTCYP1A2CYP2C19NPC1RAB9A | |
| SCHEMBL3302189 | 0.81 | ALDH1A1 (0.35) | HTTCYP1A2CYP2C19NPC1RAB9A | |
| SCHEMBL3307757 | 0.81 | AHR (0.41) | HTTCYP1A2CYP2C19NPC1RAB9A | |
| SCHEMBL3304131 | 0.81 | ALDH1A1 (0.40) | HTTCYP1A2CYP2C19NPC1RAB9A | |
| SCHEMBL1612114 | 0.78 | CHRNB4 (0.40) | NPC1RAB9ACHRNB4CHRNA3CHRNA1 | |
| SCHEMBL22324000 | 0.75 | PDGFRB (0.46) | CCNB2CDK1CCNB1GSK3AGSK3B | |
| SCHEMBL3307262 | 0.75 | MAPK1 (0.33) | ALDH1A1MAPK1HSD17B10ALOX15MAPK10 | |
| SCHEMBL30217734 | 0.75 | MAPK1 (0.33) | CCNB2CDK1CCNB1GSK3AGSK3B | |
| SCHEMBL16040498 | 0.75 | MAPK1 (0.33) | CCNB2CDK1CCNB1GSK3AGSK3B |
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-115028592-A | Photochromic diaryl ethylene compound and preparation method and application thereof | 济宁医学院 | 2022-09-09 | — | — | CN | claimed |
| CN-117777031-A | Synthesis method of 2-phenyl quinoxaline derivative under photocatalysis condition | 福建医科大学 | 2024-03-29 | — | — | CN | disclosed |
| CN-115028592-A | Photochromic diaryl ethylene compound and preparation method and application thereof | 济宁医学院 | 2022-09-09 | — | — | CN | disclosed |
| CN-113087674-B | Method for synthesizing quinoxaline compound under catalysis of visible light induced photosensitizer | 河南大学 | 2022-06-17 | — | — | CN | disclosed |