Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.43 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL28042278 | 0.79 | ALOX15 (0.74) | ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2 | |
| SCHEMBL2495608 | 0.79 | ENPP1 (0.57) | ALDH1A1MEN1KMT2AENPP3ENPP1 | |
| SCHEMBL22373678 | 0.75 | CYP1A1 (0.49) | ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2 | |
| Formaldehyde SCHEMBL23148501 | 0.74 | CA12 (0.53) | ENPP3ENPP1FLT3CYP1A2CYP2C19 | |
| SCHEMBL21120704 | 0.73 | ENPP3 (0.47) | ALDH1A1MEN1KMT2AENPP3ENPP1 | |
| SCHEMBL29222580 | 0.73 | DHFR (0.46) | ALDH1A1ENPP3ENPP1FLT3TDP1 | |
| SCHEMBL22373730 | 0.72 | CYP1A1 (0.50) | ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2 | |
| SCHEMBL18731830 | 0.72 | L3MBTL1 (0.51) | ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2 | |
| SCHEMBL22978418 | 0.71 | ENPP1 (0.46) | ALDH1A1MEN1KMT2AENPP3ENPP1 | |
| SCHEMBL25866329 | 0.71 | CA12 (0.53) | ALDH1A1ENPP3ENPP1FLT3MAPT |
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-108794412-B | Preparation method of 4, 5-diaryl-2H-1, 2, 3-triazole compound | 海南师范大学 | 2020-06-30 | — | — | CN | disclosed |