Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 4/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.40 |
| ▸ | RELA | Q04206 | 4/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28039500 | 1.00 | NFKB1 (0.40) | NFKB1NFKB2RELAMAOAMAOB | |
| SCHEMBL28199169 | 0.77 | MAPK1 (0.33) | NFKB1NFKB2RELA | |
| SCHEMBL28198527 | 0.77 | NFKB1 (0.40) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL16228485 | 0.77 | NFKB1 (0.40) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL4715774 | 0.75 | MAPT (0.47) | NFKB1NFKB2RELAMAOBKDM1A | |
| SCHEMBL19497263 | 0.75 | NFKB1 (0.45) | NFKB1NFKB2RELAMAOBKDM1A | |
| SCHEMBL16228549 | 0.74 | NFKB1 (0.40) | NFKB1NFKB2RELAMAOBKDM1A | |
| SCHEMBL29046653 | 0.74 | BTK (0.47) | NFKB1NFKB2RELAMAOBKDM1A | |
| SCHEMBL29046655 | 0.74 | BTK (0.47) | NFKB1NFKB2RELAMAOBKDM1A | |
| SCHEMBL15649423 | 0.74 | BTK (0.40) | NFKB1NFKB2RELAMAOAMAOB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105143212-B | Tripeptide epoxy ketone protease inhibitors | 欧尼斯治疗公司 | 2018-02-23 | — | — | CN | disclosed |