Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.40 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | FNTA | P49354 | 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 | |
|---|---|---|---|---|
| SCHEMBL28707856 | 0.87 | TAAR1 (0.46) | MAOBLTA4HPGRARMEN1 | |
| SCHEMBL28717361 | 0.85 | CYP11B1 (0.44) | CYP11B1CYP11B2ARALDH1A1KDM4E | |
| SCHEMBL24872544 | 0.85 | TRPV4 (0.45) | MAOBCYP11B1CYP11B2ARMAOA | |
| SCHEMBL188284 | 0.82 | MAOB (0.55) | MAOBPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1017145 | 0.81 | CYP11B1 (0.47) | MAOBCYP11B1CYP11B2PGRAR | |
| SCHEMBL30079514 | 0.81 | CYP11B1 (0.47) | MAOBCYP11B1CYP11B2PGRAR | |
| SCHEMBL5361453 | 0.81 | ALDH1A1 (0.49) | MAOBLTA4HPGRARALDH1A1 | |
| SCHEMBL30037290 | 0.80 | IDH1 (0.43) | MAOBLTA4HKDM4EMAOAFNTA | |
| SCHEMBL3512013 | 0.80 | IDH1 (0.43) | MAOBLTA4HKDM4EMAOAFNTA | |
| SCHEMBL27282525 | 0.79 | MAOB (0.80) | MAOBCYP11B1CYP11B2ARALDH1A1 |
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-114230518-A | Preparation method of 5-benzyl-1H-indazole-3-amine compound | 海南梵圣生物科技有限公司 | 2022-03-25 | — | — | CN | disclosed |