Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | IAPP | P10997 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7445471 | 0.85 | KEAP1 (0.44) | ALDH1A1NPSR1FAAHHPGDKDM4E | |
| SCHEMBL31715510 | 0.83 | NPSR1 (0.43) | ALDH1A1NPSR1FAAHHPGDGRM5 | |
| SCHEMBL6564804 | 0.83 | NPSR1 (0.43) | ALDH1A1NPSR1FAAHHPGDGRM5 | |
| SCHEMBL17441457 | 0.83 | KCNH2 (0.37) | ALDH1A1NPSR1FAAHHPGDGRM5 | |
| SCHEMBL23599140 | 0.83 | KDM4E (0.46) | ALDH1A1NPSR1FAAHHPGDSMN1; SMN2 | |
| SCHEMBL1511343 | 0.80 | CYP4F2 (0.48) | ALDH1A1SMN1; SMN2KDM4ELMNACYP1A2 | |
| SCHEMBL19837458 | 0.79 | ALDH1A1 (0.47) | ALDH1A1IAPPNPSR1HPGDSMN1; SMN2 | |
| SCHEMBL4573420 | 0.79 | TRPM5 (0.45) | ALDH1A1IAPPNPSR1HPGDSMN1; SMN2 | |
| SCHEMBL17440498 | 0.79 | KCNH2 (0.38) | ALDH1A1NPSR1FAAHHPGDSMN1; SMN2 | |
| SCHEMBL7437586 | 0.79 | SMN1; SMN2 (0.47) | ALDH1A1FAAHHPGDSMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3322702-A1 | CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER | Mission Therapeutics Limited (GB) | 2018-05-23 | — | — | EP | disclosed |
| WO-2017009650-A1 | CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER | MISSION THERAPEUTICS LIMITED (GB) | 2017-01-19 | — | — | WO | disclosed |
| WO-2016011390-A1 | IRAK4 INHIBITING AGENTS | BIOGEN MA INC. (US) | 2016-01-21 | — | — | WO | disclosed |