Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8389745 | 0.81 | HSD17B10 (0.48) | NR1H4MAPTPKMCA1CA2 | |
| SCHEMBL11703903 | 0.79 | NR1H4 (0.45) | NR1H4CA1CA2ALDH1A1SMN1; SMN2 | |
| SCHEMBL768507 | 0.77 | ALDH1A1 (0.61) | NR1H4MAPTCA1CA2HSD17B10 | |
| SCHEMBL11317922 | 0.77 | HSD17B10 (0.50) | NR1H4MAPTCA1CA2HSD17B10 | |
| SCHEMBL818330 | 0.75 | HSD17B10 (0.48) | NR1H4MAPTCA1CA2HSD17B10 | |
| SCHEMBL449378 | 0.73 | ALDH1A1 (0.56) | MAPTCA1CA2HSD17B10ALDH1A1 | |
| SCHEMBL2799510 | 0.71 | KMT2A (0.63) | MAPTALDH1A1SMN1; SMN2MAPK1TSHR | |
| SCHEMBL30553151 | 0.70 | ALOX15 (0.44) | NR1H4MAPTCA1CA2HSD17B10 | |
| SCHEMBL12804190 | 0.70 | HSD17B10 (0.43) | NR1H4MAPTCA1CA2HSD17B10 | |
| SCHEMBL2437476 | 0.70 | ALOX15 (0.44) | NR1H4MAPTCA1CA2HSD17B10 |
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-110092782-A | A kind of benzo six-membered heterocycle compound and its preparation method and application | 中国科学院广州生物医药与健康研究院 | 2019-08-06 | — | — | CN | disclosed |