Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCPS | Q96C86 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ELANE | P08246 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | NQO2 | P16083 | 2/20 | 0.41 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | APAF1 | O14727 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21596935 | 0.81 | ALDH1A1 (0.44) | DCPSALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL21596923 | 0.75 | ELANE (0.35) | DCPSALDH1A1KDM4EELANEDHFR | |
| SCHEMBL21596927 | 0.74 | FYN (0.41) | ALDH1A1KDM4EHPGDUSP2TP53 | |
| SCHEMBL21596912 | 0.73 | FYN (0.46) | ALDH1A1GAA | |
| SCHEMBL21596930 | 0.72 | NQO2 (0.41) | ALDH1A1KDM4ENQO2ALOX15MEN1 | |
| SCHEMBL4367263 | 0.72 | ACHE (0.39) | ACHERPS6KA2HTR5A | |
| SCHEMBL21596942 | 0.72 | BACE1 (0.40) | — | |
| SCHEMBL21596915 | 0.72 | PARP1 (0.41) | ELANEACHEPTGS1DHFRGAA | |
| SCHEMBL1781983 | 0.71 | KDR (0.50) | DCPSALDH1A1ADRA2BPTGS1TDP1 | |
| SCHEMBL21596936 | 0.69 | ALDH1A1 (0.33) | ALDH1A1MAPK1GAAHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-3810602-A1 | COMPOUNDS | CTXT Pty Limited (AU) | 2021-04-28 | — | — | EP | disclosed |
| WO-2019243491-A1 | COMPOUNDS | CTXT PTY LIMITED (AU) | 2019-12-26 | — | — | WO | disclosed |