Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATXN2 | Q99700 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 8/20 | 0.34 |
| ▸ | CDK1 | P06493 | 7/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 2/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.33 |
| ▸ | CDK7 | P50613 | 4/20 | 0.33 |
| ▸ | CDK9 | P50750 | 4/20 | 0.33 |
| ▸ | CCNH | P51946 | 4/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1700813 | 0.87 | XDH (0.38) | ATXN2BRD4PTGS1PTGS2CTSS | |
| SCHEMBL28922124 | 0.86 | ATXN2 (0.40) | ATXN2BRD4FFAR2CDK2CDK1 | |
| SCHEMBL1955447 | 0.79 | XDH (0.44) | ATXN2BRD4FFAR2CDK2CDK1 | |
| SCHEMBL1700247 | 0.76 | GPR84 (0.40) | BRD4 | |
| SCHEMBL1699964 | 0.75 | CA1 (0.56) | CDK1PTGS1PTGS2 | |
| SCHEMBL1700291 | 0.72 | ATXN2 (0.37) | ATXN2BRD4FFAR2 | |
| SCHEMBL1700710 | 0.70 | ALDH1A1 (0.49) | CNR1CNR2 | |
| SCHEMBL1958508 | 0.70 | BCL2 (0.36) | PTGS1PTGS2ENPP1 | |
| SCHEMBL1699954 | 0.69 | BRD4 (0.41) | ATXN2BRD4FFAR2CDK2CDK1 | |
| SCHEMBL25176122 | 0.69 | CTSS (0.39) | CTSSCNR2XDH |
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-109897038-B | Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases | 艾伯维爱尔兰无限公司 | 2022-04-05 | — | — | CN | disclosed |
| CN-108175749-B | Melt-extruded solid dispersions containing apoptosis-inducing agents | 艾伯维爱尔兰无限公司 | 2021-09-10 | — | — | CN | disclosed |