Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | MAPT | P10636 | 6/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.62 |
| ▸ | PKM | P14618 | 1/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.52 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.52 |
| ▸ | CDK9 | P50750 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | NPBWR1 | P48145 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28289713 | 0.92 | ALDH1A1 (0.65) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL28307941 | 0.89 | KDM4E (0.68) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL7350393 | 0.85 | KDM4E (0.67) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL7608611 | 0.83 | KDM4E (0.85) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL1250581 | 0.82 | KDM4E (0.82) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL28291116 | 0.82 | KDM4E (0.63) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL18826611 | 0.81 | KDM4E (0.52) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL9721028 | 0.81 | KDM4E (0.81) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL783687 | 0.81 | KDM4E (0.81) | KDM4EALDH1A1MAPTLMNAKCNJ1 | |
| SCHEMBL9720952 | 0.81 | KDM4E (0.81) | KDM4EALDH1A1MAPTLMNAKCNJ1 |
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-109593804-B | Method for quickly synthesizing nitrobenzimidazole derivative through enzyme catalysis | 浙江工业大学 | 2021-06-08 | — | — | CN | disclosed |
| CN-109593804-A | A kind of method of enzymatic rapid synthesis nitrobenzimidazole analog derivative | 浙江工业大学 | 2019-04-09 | — | — | CN | disclosed |