Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 1/20 | 0.47 |
| ▸ | CTSD | P07339 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2554685 | 0.80 | CTSD (0.56) | CTSDHTTALDH1A1HPGDIDO1 | |
| SCHEMBL5740202 | 0.79 | MET (0.51) | METCTSDHTTALDH1A1HPGD | |
| SCHEMBL29191050 | 0.76 | MET (0.49) | METCTSDHTTALDH1A1HPGD | |
| SCHEMBL28512563 | 0.68 | CTSD (0.59) | CTSDHTTALDH1A1HPGDCA12 | |
| SCHEMBL11459770 | 0.67 | CTSD (0.68) | CTSDHTTALDH1A1HPGDCA12 | |
| SCHEMBL1577986 | 0.67 | CTSD (0.54) | CTSDHTTALDH1A1HPGDLMNA | |
| SCHEMBL11722513 | 0.67 | CA12 (0.70) | CTSDHTTALDH1A1HPGDLMNA | |
| SCHEMBL1697511 | 0.66 | ALDH1A1 (0.59) | CTSDHTTALDH1A1LMNAKDM4E | |
| SCHEMBL31738412 | 0.66 | CTSD (0.61) | CTSDHTTALDH1A1HPGDCA12 | |
| SCHEMBL29156524 | 0.66 | CTSD (0.61) | CTSDHTTALDH1A1HPGDCA12 |
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-113480465-B | Preparation method of 1- (2-nitrobenzyl) pyrrole-2-formaldehyde | 埃斯特维华义制药有限公司 | 2023-07-21 | — | — | CN | disclosed |
| CN-113480465-A | Preparation method of 1- (2-nitrobenzyl) pyrrole-2-formaldehyde | 埃斯特维华义制药有限公司 | 2021-10-08 | — | — | CN | disclosed |