Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.73 |
| ▸ | GAA | P10253 | 1/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | MEN1 | O00255 | 6/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.55 |
| ▸ | POLB | P06746 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.55 |
| ▸ | XBP1 | P17861 | 1/20 | 0.55 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.55 |
| ▸ | CCR6 | P51684 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | MITF | O75030 | 1/20 | 0.54 |
| ▸ | CASP6 | P55212 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL30817653 | 1.00 | ALDH1A1 (0.73) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL7479419 | 1.00 | ALDH1A1 (0.73) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL14357435 | 0.88 | KDM4E (0.74) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL11867527 | 0.87 | KDM4E (0.63) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL18589087 | 0.85 | ALDH1A1 (0.57) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL15046562 | 0.82 | SMN1; SMN2 (0.62) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL4671276 | 0.82 | NPC1 (0.55) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL14296956 | 0.81 | KDM4E (0.66) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL11068195 | 0.81 | KDM4E (0.60) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 | |
| SCHEMBL10999884 | 0.81 | SMN1; SMN2 (1.00) | ALDH1A1KDM4EGAASMN1; SMN2MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117756782-A | Preparation method of arbeli intermediate 5- [ (4-ethylpiperazine-1-yl) methyl ] pyridin-2-amine | 江苏希迪制药有限公司 | 2024-03-26 | — | — | CN | claimed |
| CN-117720459-A | Preparation process of arbeli intermediate 5- [ (4-ethylpiperazine-1-yl) methyl ] pyridin-2-amine | 江苏希迪制药有限公司 | 2024-03-19 | — | — | CN | claimed |
| CN-117756782-A | Preparation method of arbeli intermediate 5- [ (4-ethylpiperazine-1-yl) methyl ] pyridin-2-amine | 江苏希迪制药有限公司 | 2024-03-26 | — | — | CN | disclosed |
| CN-117720459-A | Preparation process of arbeli intermediate 5- [ (4-ethylpiperazine-1-yl) methyl ] pyridin-2-amine | 江苏希迪制药有限公司 | 2024-03-19 | — | — | CN | disclosed |