Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | XDH | P47989 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | GALR3 | O60755 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | SI | P14410 | 1/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28610385 | 0.85 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2MAPTXDHTSHR | |
| SCHEMBL28591593 | 0.84 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2MAPTXDHTSHR | |
| SCHEMBL28599608 | 0.80 | XDH (0.51) | ALDH1A1SMN1; SMN2MAPTXDHTSHR | |
| Hydrochloric Acid SCHEMBL28591146 | 0.80 | MEN1 (0.53) | ALDH1A1SMN1; SMN2MAPTXDHTSHR | |
| SCHEMBL29483664 | 0.79 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2XDHTSHRTDP1 | |
| SCHEMBL28918796 | 0.79 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2XDHTSHRTDP1 | |
| SCHEMBL28604078 | 0.77 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2XDHTSHRTDP1 | |
| SCHEMBL28918207 | 0.77 | SMN1; SMN2 (0.51) | ALDH1A1SMN1; SMN2MAPTXDHTSHR | |
| SCHEMBL28604068 | 0.77 | SMN1; SMN2 (0.51) | ALDH1A1SMN1; SMN2XDHTSHRTDP1 | |
| SCHEMBL28601576 | 0.76 | XDH (0.47) | ALDH1A1SMN1; SMN2MAPTXDHTSHR |
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-113173918-B | N-indole-1, 6-dihydropyrimidine-4-carboxamide derivative and preparation method and application thereof | 沈阳药科大学 | 2022-04-05 | — | — | CN | disclosed |
| CN-113173918-A | N-indole-1, 6-dihydropyrimidine-4-carboxamide derivative and preparation method and application thereof | 沈阳药科大学 | 2021-07-27 | — | — | CN | disclosed |