Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPT1A | P50416 | 1/20 | 0.43 |
| ▸ | XIAP | P98170 | 2/20 | 0.41 |
| ▸ | BIRC3 | Q13489 | 2/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 8/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 5/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CCR3 | P51677 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23119917 | 0.84 | TBXA2R (0.43) | XIAPBIRC3TBXA2RTNFTP53 | |
| SCHEMBL23119926 | 0.82 | BIRC3 (0.42) | XIAPBIRC3TBXA2RAGTR1AGTR2 | |
| SCHEMBL23119904 | 0.82 | TBXA2R (0.40) | CPT1ATBXA2RAGTR1AGTR2 | |
| SCHEMBL23133893 | 0.73 | BIRC3 (0.69) | XIAPBIRC3TNF | |
| SCHEMBL23133989 | 0.73 | BIRC3 (0.54) | XIAPBIRC3TNF | |
| SCHEMBL27165383 | 0.73 | HTR2A (0.43) | — | |
| SCHEMBL27204380 | 0.73 | HTR2A (0.43) | — | |
| SCHEMBL20956724 | 0.72 | BIRC3 (0.62) | XIAPBIRC3TNF | |
| SCHEMBL20956728 | 0.72 | BIRC3 (0.62) | XIAPBIRC3TNF | |
| SCHEMBL20956727 | 0.72 | BIRC3 (0.62) | XIAPBIRC3TNF |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112521372-B | Apoptosis protein inhibitor and preparation method and application thereof | 南京华威医药科技集团有限公司 | 2022-07-08 | — | — | CN | disclosed |
| WO-2021051827-A1 | APOPTOSIS PROTEIN INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 南京华威医药科技集团有限公司 | 2021-03-25 | — | — | WO | disclosed |
| CN-112521372-A | Apoptosis protein inhibitor and preparation method and application thereof | 南京华威医药科技集团有限公司 | 2021-03-19 | — | — | CN | disclosed |