Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.40 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28603844 | 1.00 | CYP1A1 (0.46) | CYP1A1MAOBCYP1B1RAB9ANPC1 | |
| SCHEMBL28611350 | 0.89 | RAB9A (0.46) | RAB9ANPC1MEN1KMT2AMAPT | |
| SCHEMBL28611353 | 0.89 | RAB9A (0.46) | RAB9ANPC1MEN1KMT2AMAPT | |
| SCHEMBL28611349 | 0.88 | NPC1 (0.48) | RAB9ANPC1MEN1KMT2AMAPT | |
| SCHEMBL28611345 | 0.88 | NPC1 (0.48) | RAB9ANPC1MEN1KMT2AMAPT | |
| SCHEMBL28755238 | 0.86 | GAA (0.50) | CYP1A1MAOBCYP1B1RAB9ANPC1 | |
| SCHEMBL28603846 | 0.86 | ALDH1A1 (0.50) | RAB9ANPC1MEN1KMT2AMAPT | |
| SCHEMBL28603848 | 0.86 | ALDH1A1 (0.50) | RAB9ANPC1MEN1KMT2AMAPT | |
| SCHEMBL28603842 | 0.86 | ALDH1A1 (0.50) | RAB9ANPC1MEN1KMT2AMAPT | |
| SCHEMBL28603850 | 0.86 | ALDH1A1 (0.50) | RAB9ANPC1MEN1KMT2AMAPT |
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-108503600-B | Polysubstituted quinoxaline derivative and preparation method thereof | 华侨大学 | 2021-08-03 | — | — | CN | disclosed |