Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL28008873 | 0.85 | PTPN5 (0.35) | — | |
| SCHEMBL28009293 | 0.81 | IDO1 (0.39) | DAO | |
| SCHEMBL28009292 | 0.79 | LTA4H (0.44) | — | |
| SCHEMBL28008868 | 0.76 | CYP17A1 (0.36) | CYP17A1CYP11B1CYP11B2ALDH1A1HTT | |
| SCHEMBL28648372 | 0.73 | PDK2 (0.35) | — | |
| SCHEMBL3299911 | 0.72 | CYP17A1 (0.52) | CYP17A1CYP11B1CYP11B2ALDH1A1HTT | |
| SCHEMBL899948 | 0.71 | GPR3 (0.36) | — | |
| SCHEMBL407749 | 0.70 | P2RX1 (0.33) | — | |
| SCHEMBL1510448 | 0.69 | FFAR1 (0.45) | — | |
| SCHEMBL622940 | 0.68 | GPR3 (0.41) | — |
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-102596923-B | 1,2, 4-thiazolidin-3-one derivatives and their use in the treatment of cancer | BALTIC BIO AB | 2015-04-29 | — | — | CN | claimed |
| CN-102596923-B | 1,2, 4-thiazolidin-3-one derivatives and their use in the treatment of cancer | BALTIC BIO AB | 2015-04-29 | — | — | CN | disclosed |