Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.65 |
| ▸ | USP2 | O75604 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | RIPK1 | Q13546 | 4/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | MMP2 | P08253 | 1/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.52 |
| ▸ | CASP3 | P42574 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL271677 | 0.85 | MEN1 (0.74) | MEN1KMT2AUSP2POLBRIPK1 | |
| SCHEMBL10752988 | 0.82 | MEN1 (0.70) | MEN1KMT2AUSP2POLBRIPK1 | |
| SCHEMBL5213718 | 0.79 | MEN1 (0.74) | MEN1KMT2AUSP2POLBRIPK1 | |
| SCHEMBL28003574 | 0.76 | MEN1 (0.64) | MEN1KMT2AUSP2POLBRIPK1 | |
| SCHEMBL4328218 | 0.75 | ALDH1A1 (0.69) | MEN1KMT2AUSP2POLBRIPK1 | |
| SCHEMBL7503025 | 0.75 | MEN1 (0.60) | MEN1KMT2AUSP2POLBRIPK1 | |
| SCHEMBL7035627 | 0.75 | MEN1 (0.67) | MEN1KMT2AUSP2POLBRIPK1 | |
| SCHEMBL18782981 | 0.74 | KDM4E (0.66) | MEN1KMT2AUSP2POLBRIPK1 | |
| SCHEMBL1171437 | 0.74 | NPC1 (0.82) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL27991181 | 0.74 | ALDH1A1 (0.71) | MEN1KMT2AUSP2POLBRIPK1 |
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-109593804-A | A kind of method of enzymatic rapid synthesis nitrobenzimidazole analog derivative | 浙江工业大学 | 2019-04-09 | — | — | CN | disclosed |