Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CNR1 | P21554 | 5/20 | 0.39 |
| ▸ | CNR2 | P34972 | 4/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | APAF1 | O14727 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ICMT | O60725 | 1/20 | 0.37 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CDC25A | P30304 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | P2RX4 | Q99571 | 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 | |
|---|---|---|---|---|
| SCHEMBL28375695 | 0.75 | KDM4E (0.43) | KDM4EALDH1A1HSD17B10IDO1APAF1 | |
| SCHEMBL28435403 | 0.74 | SRC (0.43) | CNR2EGFRSRC | |
| SCHEMBL29003631 | 0.74 | KDM4E (0.62) | KDM4EALDH1A1HSD17B10IDO1APAF1 | |
| SCHEMBL12986382 | 0.73 | KDM4E (0.72) | KDM4EALDH1A1HSD17B10IDO1APAF1 | |
| SCHEMBL27736942 | 0.71 | EPHX1 (0.39) | KDM4EALDH1A1HSD17B10POLB | |
| SCHEMBL5607127 | 0.71 | ALDH1A1 (0.42) | ALDH1A1POLB | |
| SCHEMBL28369964 | 0.70 | TSHR (0.44) | KDM4EALDH1A1HSD17B10CNR1CDC25A | |
| SCHEMBL12986273 | 0.70 | KDM4E (0.56) | KDM4EALDH1A1HSD17B10IDO1APAF1 | |
| SCHEMBL4757419 | 0.70 | TAS1R3 (0.43) | ALDH1A1CNR2IDO1 | |
| SCHEMBL2183709 | 0.69 | EPHX1 (0.59) | HSD17B10 |
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-107176921-B | Indole compounds with antiviral activity in isatis root and derivatives thereof | 中国医学科学院药物研究所 | 2020-03-31 | — | — | CN | disclosed |