Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28540690 | 0.83 | KIF11 (0.50) | KIF11ALDH1A1LMNAPGRNR1H3 | |
| SCHEMBL28551592 | 0.83 | MEN1 (0.46) | SRCALDH1A1LMNACYP2C19HSD17B10 | |
| SCHEMBL28281378 | 0.82 | MEN1 (0.44) | ALDH1A1LMNACYP2C19HSD17B10MAPT | |
| SCHEMBL28540636 | 0.81 | ALDH1A1 (0.42) | ALDH1A1LMNACYP2C19HSD17B10MAPT | |
| SCHEMBL28282812 | 0.81 | MAPT (0.46) | ALDH1A1LMNACYP2C19HSD17B10MAPT | |
| SCHEMBL28282805 | 0.81 | CCNB2 (0.43) | SRCALDH1A1LMNACYP2C19HSD17B10 | |
| SCHEMBL1435718 | 0.79 | ALDH1A1 (0.57) | ALDH1A1LMNACYP2C19HSD17B10MAPT | |
| SCHEMBL28282810 | 0.77 | MAOA (0.44) | SRCALDH1A1LMNACYP2C19HSD17B10 | |
| SCHEMBL28425173 | 0.76 | MAPT (0.57) | SRCALDH1A1LMNAMAPTPOLB | |
| SCHEMBL28281379 | 0.73 | ALDH1A1 (0.40) | SRCALDH1A1LMNACYP2C19HSD17B10 |
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-110526855-B | Preparation method of 3-nitroso substituted indole derivative | 郑州大学 | 2020-11-27 | — | — | CN | disclosed |