Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 5/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 5/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8469817 | 0.90 | KEAP1 (0.40) | ALDH1A1KEAP1PIK3CGCA2CA12 | |
| SCHEMBL8074300 | 0.89 | ALDH1A1 (0.40) | ALDH1A1KEAP1PIK3CGCA2LMNA | |
| Bromide SCHEMBL8080918 | 0.86 | KEAP1 (0.45) | ALDH1A1KEAP1CA2CA12CA1 | |
| SCHEMBL8076290 | 0.86 | KEAP1 (0.40) | KEAP1PIK3CGCA2CA12CA1 | |
| SCHEMBL8079548 | 0.84 | ALDH1A1 (0.38) | ALDH1A1KEAP1CA2LMNAGAA | |
| SCHEMBL8079566 | 0.83 | LMNA (0.37) | ALDH1A1CA2CA12CA1CA9 | |
| SCHEMBL9407932 | 0.80 | LMNA (0.35) | ALDH1A1CA2CA12CA1CA9 | |
| SCHEMBL8470105 | 0.80 | ALDH1A1 (0.43) | ALDH1A1KEAP1PIK3CGLMNAGAA | |
| SCHEMBL9407920 | 0.80 | CXCR3 (0.34) | CA2LMNASMN1; SMN2MAPT | |
| SCHEMBL8074297 | 0.80 | TSHR (0.40) | ALDH1A1KEAP1CA2CA12CA1 |
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-0330050-B1 | Special chemiluminescent acridine derivatives and their use in luminescence immunoassays | DADE BEHRING MARBURG GMBH (DE) | 2000-08-23 | — | — | EP | disclosed |
| EP-0602524-A1 | Chemiluminescence marked sequences and their use in sequence testing | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-06-22 | — | — | EP | disclosed |
| EP-0330050-A2 | Special chemiluminescent acridine derivatives and their use in luminescence immunoassays | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-08-30 | — | — | EP | disclosed |