Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.56 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5226731 | 0.86 | ABL1 (0.50) | ABL1NR4A2RXFP1MAPTSMN1; SMN2 | |
| SCHEMBL29134446 | 0.82 | NR4A2 (0.43) | ABL1NR4A2MAPTL3MBTL1CA2 | |
| SCHEMBL9660296 | 0.82 | ABL1 (0.53) | ABL1NR4A2RXFP1MAPTSMN1; SMN2 | |
| SCHEMBL25826611 | 0.81 | ABL1 (0.63) | ABL1NR4A2RXFP1MAPTSMN1; SMN2 | |
| SCHEMBL21505100 | 0.80 | HSD17B10 (0.65) | MAPTL3MBTL1NPC1RAB9ACA2 | |
| SCHEMBL4071201 | 0.80 | ABL1 (0.60) | ABL1NR4A2RXFP1MAPTSMN1; SMN2 | |
| SCHEMBL9660294 | 0.77 | ABL1 (0.53) | ABL1NR4A2RXFP1MAPTSMN1; SMN2 | |
| SCHEMBL19437595 | 0.74 | ABL1 (0.53) | ABL1NR4A2RXFP1MAPTSMN1; SMN2 | |
| SCHEMBL21251011 | 0.73 | ABL1 (0.56) | ABL1NR4A2MAPTALDH1A1CYP1A2 | |
| SCHEMBL2473934 | 0.73 | ABL1 (0.53) | ABL1NR4A2RXFP1MAPTSMN1; SMN2 |
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-111518055-A | Preparation method of benzothiazepine oxide, product prepared by preparation method and application of product | 西安都创医药科技有限公司 | 2020-08-11 | — | — | CN | claimed |
| CN-111518055-A | Preparation method of benzothiazepine oxide, product prepared by preparation method and application of product | 西安都创医药科技有限公司 | 2020-08-11 | — | — | CN | disclosed |