Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | RXRA | P19793 | 1/20 | 0.50 |
| ▸ | RXRB | P28702 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 5/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.42 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.41 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.41 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.41 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.41 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.41 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | NQO2 | P16083 | 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 | |
|---|---|---|---|---|
| SCHEMBL29164506 | 0.92 | HTT (0.61) | HTTALDH1A1RXRARXRBIDO1 | |
| SCHEMBL2643777 | 0.83 | HTT (0.44) | HTTALDH1A1RXRARXRBIDO1 | |
| SCHEMBL5242703 | 0.82 | ALDH1A1 (0.57) | ALDH1A1ABCG2NR4A2 | |
| SCHEMBL29051452 | 0.82 | HTT (0.68) | HTTALDH1A1RXRARXRBIDO1 | |
| SCHEMBL29164521 | 0.81 | HTT (0.66) | HTTALDH1A1RXRARXRBIDO1 | |
| SCHEMBL5243737 | 0.81 | NR4A2 (0.63) | ALDH1A1ABCG2MTNR1AMTNR1BNR4A2 | |
| SCHEMBL2137224 | 0.80 | HTT (0.64) | HTTRXRARXRBIDO1 | |
| SCHEMBL28849060 | 0.80 | HTT (0.64) | HTTALDH1A1RXRARXRBIDO1 | |
| SCHEMBL29164497 | 0.80 | HTT (0.64) | HTTRXRARXRBIDO1 | |
| SCHEMBL29644287 | 0.80 | HTT (0.64) | HTTRXRARXRBIDO1 |
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-116574048-A | Bromination reaction method of remote indole C-H bond by using sunlight catalysis | 陕西科技大学 | 2023-08-11 | — | — | CN | claimed |
| CN-116574048-A | Bromination reaction method of remote indole C-H bond by using sunlight catalysis | 陕西科技大学 | 2023-08-11 | — | — | CN | disclosed |