Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AADAT | Q8N5Z0 | 3/20 | 0.43 |
| ▸ | B3GAT3 | O94766 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28984925 | 1.00 | AADAT (0.43) | AADATB3GAT3ALDH1A1HTTSLC6A2 | |
| SCHEMBL4328191 | 0.82 | P2RX7 (0.47) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| SCHEMBL28985342 | 0.79 | B3GAT3 (0.44) | AADATB3GAT3ALDH1A1HTTMETAP2 | |
| SCHEMBL4333242 | 0.74 | HTT (0.47) | ALDH1A1HTTMAPTCYP3A4TSHR | |
| SCHEMBL14275584 | 0.74 | HTT (0.47) | ALDH1A1HTTMAPTCYP3A4TSHR | |
| SCHEMBL29268436 | 0.74 | B3GAT3 (0.58) | B3GAT3 | |
| SCHEMBL30267466 | 0.74 | B3GAT3 (0.53) | B3GAT3 | |
| SCHEMBL13419433 | 0.73 | ALDH1A1 (0.53) | AADATALDH1A1HTTCYP2D6MAPT | |
| SCHEMBL14275593 | 0.73 | HSD11B1 (0.52) | ALDH1A1HTTMAPT | |
| SCHEMBL29268432 | 0.72 | B3GAT3 (0.51) | B3GAT3 |
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-115974849-B | Indolyloxy acetamide derivative, pharmaceutical composition containing same and application of pharmaceutical composition | 中国药科大学 | 2024-06-21 | — | — | CN | disclosed |
| CN-115974849-A | Indoxyl acetamide derivative, pharmaceutical composition containing indoxyl acetamide derivative and application of indoxyl acetamide derivative | 中国药科大学 | 2023-04-18 | — | — | CN | disclosed |