Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6492 | 0.83 | TSHR (0.39) | TSHRNFKB1CYP2C19 | |
| Hno SCHEMBL15954661 | 0.78 | TSHR (0.37) | TSHRNFKB1CYP2C19 | |
| SCHEMBL49750 | 0.77 | TSHR (0.31) | TSHRNFKB1CYP2C19 | |
| SCHEMBL6567522 | 0.77 | TSHR (0.34) | TSHRNFKB1CYP2C19 | |
| Hypochlorous Acid SCHEMBL15633664 | 0.75 | TSHR (0.40) | TSHRNFKB1CYP2C19 | |
| SCHEMBL5084504 | 0.75 | TSHR (0.35) | TSHRNFKB1CYP2C19 | |
| SCHEMBL2363259 | 0.73 | TSHR (0.43) | TSHRNFKB1CYP2C19 | |
| SCHEMBL6628615 | 0.73 | TSHR (0.34) | TSHRNFKB1CYP2C19 | |
| SCHEMBL5096697 | 0.73 | TSHR (0.34) | TSHRNFKB1CYP2C19 | |
| SCHEMBL1082541 | 0.73 | TSHR (0.43) | TSHRNFKB1CYP2C19 |
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-108602803-A | Piperidinobenzodiazepine compounds with antiproliferative activity | 福姆通格尼克斯有限公司 | 2018-09-28 | — | — | CN | disclosed |
| CN-108368023-A | Total synthesis method of dissipatin E1 | 萨尔兹曼拉芙蕾丝投资有限公司 | 2018-08-03 | — | — | CN | disclosed |