Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.52 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.52 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.47 |
| ▸ | NQO2 | P16083 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MIF | P14174 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27759166 | 0.81 | PARP1 (0.57) | PARP1PARP2PARP3ADORA3ADORA1 | |
| SCHEMBL22946641 | 0.76 | MCHR1 (0.47) | NQO2MEN1NPC1RAB9AKMT2A | |
| SCHEMBL27730703 | 0.75 | PARP1 (0.54) | PARP1PARP2PARP3ADORA3ADORA1 | |
| SCHEMBL1422526 | 0.75 | PARP1 (0.68) | PARP1PARP2PARP3MEN1KMT2A | |
| SCHEMBL11685099 | 0.74 | ESR2 (0.54) | ADORA3ADORA1ADORA2AADORA2BNQO2 | |
| SCHEMBL20373407 | 0.74 | CYP3A4 (0.44) | PARP1ADORA3ADORA1ADORA2AADORA2B | |
| SCHEMBL11836328 | 0.70 | RAB9A (0.49) | MEN1NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL26654519 | 0.70 | ESR2 (0.49) | ADORA3ADORA1ADORA2AADORA2BNQO2 | |
| SCHEMBL2625728 | 0.70 | ADORA1 (0.52) | PARP1PARP2PARP3ADORA3ADORA1 | |
| SCHEMBL19002401 | 0.69 | RAB9A (0.51) | ADORA3ADORA1ADORA2AMEN1NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805209-B | Preparation method of visible light-induced 3-aryl-2H-indazole compound | 河南工程学院 | 2023-05-26 | — | — | CN | disclosed |
| CN-114805209-A | Preparation method of visible light induced 3-aryl-2H-indazole compound | 河南工程学院 | 2022-07-29 | — | — | CN | disclosed |