Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CD44 | P16070 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28616932 | 0.87 | POLB (0.35) | ALDH1A1SMN1; SMN2MAPK1POLBCD44 | |
| SCHEMBL11154303 | 0.81 | TDP1 (0.39) | ALDH1A1SMN1; SMN2MAPK1TDP1MEN1 | |
| SCHEMBL4928726 | 0.81 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2MAPK1MEN1KMT2A | |
| SCHEMBL31096856 | 0.81 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2MAPK1MEN1KMT2A | |
| SCHEMBL19674785 | 0.81 | CD44 (0.35) | ALDH1A1SMN1; SMN2MAPK1POLBCD44 | |
| SCHEMBL2561658 | 0.81 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2MAPK1TDP1MEN1 | |
| SCHEMBL17427730 | 0.79 | ALDH1A1 (0.34) | ALDH1A1SMN1; SMN2MAPK1POLBCD44 | |
| SCHEMBL24455092 | 0.75 | CD44 (0.41) | ALDH1A1SMN1; SMN2KMT2APOLBCD44 | |
| SCHEMBL17703481 | 0.75 | CYP3A4 (0.37) | ALDH1A1SMN1; SMN2MAPK1TDP1MEN1 | |
| SCHEMBL10373232 | 0.75 | CD44 (0.46) | ALDH1A1SMN1; SMN2MAPK1TDP1KMT2A |
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-117756718-A | Preparation method of high-yield 3-amino-4-formamido pyrazole hemisulfate | 宜兴市星宇药业有限公司 | 2024-03-26 | — | — | CN | disclosed |