Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TK1 | P04183 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28565124 | 1.00 | NPSR1 (0.48) | NPSR1ALDH1A1CA12CA9CASP3 | |
| SCHEMBL4468251 | 0.80 | CASP3 (0.60) | ALDH1A1CA12CA9CASP3 | |
| SCHEMBL4476083 | 0.80 | CASP3 (0.60) | ALDH1A1CA12CA9CASP3 | |
| SCHEMBL8950475 | 0.80 | CASP3 (0.60) | ALDH1A1CA12CA9CASP3 | |
| SCHEMBL27949389 | 0.78 | ALDH1A1 (0.44) | NPSR1ALDH1A1CA12CA9CASP3 | |
| SCHEMBL16654972 | 0.78 | ALDH1A1 (0.50) | NPSR1ALDH1A1CA12CA9CASP3 | |
| SCHEMBL16654973 | 0.78 | ALDH1A1 (0.50) | NPSR1ALDH1A1CA12CA9CASP3 | |
| SCHEMBL2701523 | 0.77 | KMT2A (0.60) | ALDH1A1CA12CA9MEN1TSHR | |
| SCHEMBL29783149 | 0.77 | KMT2A (0.60) | ALDH1A1CA12CA9MEN1TSHR | |
| SCHEMBL8404152 | 0.76 | ALDH1A1 (0.46) | ALDH1A1CA12CA9CASP3 |
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-116813647-A | Nitrogen-containing condensed ring STING regulator compound, preparation method and application | 上海凌达生物医药有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-112778336-B | Nitrogen-containing condensed ring STING regulator compound, preparation method and application | 上海凌达生物医药有限公司 | 2023-05-05 | — | — | CN | disclosed |
| CN-112778336-A | Nitrogen-containing fused ring STING regulator compounds, preparation method and application | 上海凌达生物医药有限公司 | 2021-05-11 | — | — | CN | disclosed |
| WO-2021083383-A1 | NITROGEN-CONTAINING FUSED CYCLIC COMPOUND AS STING REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海凌达生物医药有限公司 | 2021-05-06 | — | — | WO | disclosed |