Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | CKS1B | P61024 | 1/20 | 0.37 |
| ▸ | SKP1 | P63208 | 1/20 | 0.37 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15233198 | 1.00 | NFKB1 (0.43) | NFKB1NFKB2RELAEPHX2BTK | |
| SCHEMBL6566000 | 1.00 | NFKB1 (0.43) | NFKB1NFKB2RELAEPHX2BTK | |
| SCHEMBL10013142 | 0.92 | NFKB1 (0.44) | NFKB1NFKB2RELAEPHX2BTK | |
| SCHEMBL15233218 | 0.86 | BTK (0.47) | NFKB1NFKB2RELAEPHX2BTK | |
| SCHEMBL15559191 | 0.86 | BTK (0.47) | NFKB1NFKB2RELAEPHX2BTK | |
| SCHEMBL2633760 | 0.86 | BTK (0.47) | NFKB1NFKB2RELAEPHX2BTK | |
| SCHEMBL6839332 | 0.86 | NFKB1 (0.40) | NFKB1NFKB2RELAEPHX2BTK | |
| SCHEMBL9211846 | 0.81 | GABRR1 (0.39) | CA1CA2 | |
| SCHEMBL2630499 | 0.80 | NFKB1 (0.46) | NFKB1NFKB2RELAEPHX2BTK | |
| SCHEMBL22199165 | 0.80 | NFKB1 (0.46) | NFKB1NFKB2RELAEPHX2BTK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024196851-A1 | BICYCLIC COMPOUNDS AS INACTIVATORS OF OAT AND GABA-AT | NORTHWESTERN UNIVERSITY (US) | 2024-09-26 | — | — | WO | disclosed |
| EP-1210324-A1 | SUBSTITUTED CYCLOPENTENES, THEIR PREPARATION AND THEIR USE FOR CHIRAL SCAFFOLDS | Chirotech Technology Limited (GB) | 2002-06-05 | — | — | EP | disclosed |
| WO-2001017952-A1 | SUBSTITUTED CYCLOPENTENES, THEIR PREPARATION AND THEIR USE FOR CHIRAL SCAFFOLDS | CHIROTECH TECHNOLOGY LIMITED (GB) | 2001-03-15 | — | — | WO | disclosed |