Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | RAF1 | P04049 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 3/20 | 0.35 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.35 |
| ▸ | IL1B | P01584 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28659532 | 0.87 | USP30 (0.41) | NR1H2NR1H3UCHL1IL1BP2RX7 | |
| SCHEMBL28654933 | 0.76 | USP30 (0.40) | NPC1RAB9ARAF1BRAFGPR119 | |
| SCHEMBL31473846 | 0.75 | USP2 (0.49) | IL1BP2RX7USP2SMN1; SMN2HPGD | |
| SCHEMBL14410373 | 0.72 | USP2 (0.51) | USP2SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL18394698 | 0.71 | NPC1 (0.47) | NR1H2NPC1NR1H3GPR119KMT2A | |
| SCHEMBL30701007 | 0.71 | SMN1; SMN2 (0.50) | NR1H2USP2SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL14906743 | 0.70 | USP2 (0.44) | IL1BP2RX7KMT2AUSP2SMN1; SMN2 | |
| SCHEMBL18684984 | 0.70 | USP2 (0.49) | USP2SMN1; SMN2HPGD | |
| SCHEMBL18039381 | 0.69 | USP30 (0.46) | NR1H2NPC1NR1H3UCHL1KMT2A | |
| SCHEMBL26604456 | 0.68 | NAMPT (0.43) | NR1H2GPR119RORCKDM4E |
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-113727758-A | Bicyclic heterocyclic compounds and use thereof | 锐新医药公司 | 2021-11-30 | — | — | CN | disclosed |