Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | EDNRB | P24530 | 1/20 | 0.38 |
| ▸ | EDNRA | P25101 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 2/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CETP | P11597 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | TDP2 | O95551 | 1/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 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 | |
|---|---|---|---|---|
| SCHEMBL28609468 | 0.86 | ALDH1A1 (0.47) | LMNAKIF11ALDH1A1TP53CYP1A2 | |
| SCHEMBL28607117 | 0.80 | MAOB (0.44) | LMNAEDNRATP53CYP1A2CYP3A4 | |
| SCHEMBL28607133 | 0.77 | CYP19A1 (0.48) | LMNAALDH1A1TP53CYP1A2CYP3A4 | |
| SCHEMBL28619622 | 0.77 | CYP19A1 (0.43) | LMNAALDH1A1TP53CYP1A2CYP3A4 | |
| SCHEMBL28614063 | 0.77 | CYP1A2 (0.44) | LMNACYP2C19EDNRBEDNRAALDH1A1 | |
| SCHEMBL14939148 | 0.75 | TP53 (0.58) | GPR3LMNACYP2C19ALDH1A1TSHR | |
| SCHEMBL8117184 | 0.75 | CYP1A2 (0.50) | LMNAEDNRBEDNRAALDH1A1TP53 | |
| SCHEMBL28611570 | 0.73 | LMNA (0.37) | LMNAKIF11ALDH1A1CETPTP53 | |
| SCHEMBL28414867 | 0.73 | ESR2 (0.53) | LMNAEDNRBEDNRAALDH1A1TP53 | |
| SCHEMBL4423401 | 0.71 | ESR2 (0.57) | EDNRBEDNRAALDH1A1TP53CYP3A4 |
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-109574818-B | Polysubstituted indanone derivative and preparation method thereof | 华侨大学 | 2021-08-03 | — | — | CN | disclosed |