Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | EDNRB | P24530 | 1/20 | 0.41 |
| ▸ | EDNRA | P25101 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL755309 | 0.82 | LMNA (0.60) | APEX1PTGS2LMNARAB9AKMT2A | |
| SCHEMBL20384172 | 0.82 | PTGS2 (0.53) | PTGS2LMNAKMT2AALDH1A1CA12 | |
| SCHEMBL4574077 | 0.77 | APEX1 (0.48) | APEX1PTGS2LMNARAB9AMAOA | |
| SCHEMBL30343460 | 0.77 | MAPT (0.54) | APEX1LMNARAB9AMAPK1KMT2A | |
| SCHEMBL2679084 | 0.77 | MAPT (0.54) | APEX1LMNARAB9AMAPK1KMT2A | |
| SCHEMBL5913739 | 0.75 | APEX1 (0.50) | APEX1PTGS2LMNARAB9AMAOA | |
| SCHEMBL486726 | 0.75 | ALDH1A1 (0.56) | PTGS2MAPK1KMT2AALDH1A1MAPT | |
| SCHEMBL18316 | 0.75 | APEX1 (0.50) | APEX1PTGS2LMNARAB9AMAOA | |
| SCHEMBL13601374 | 0.74 | MAPK1 (0.48) | APEX1RAB9AMAPK1KMT2AALDH1A1 | |
| SCHEMBL126575 | 0.73 | LMNA (0.50) | APEX1PTGS2LMNARAB9AMAOA |
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 |
|---|---|---|---|---|---|---|---|
| US-5140026-A | N-aminoalkyl-S-aryl-S-alkyl (or substituted alkyl) sulfoximines as antiarrhythmic agents | A. H. ROBINS COMPANY, INCORPORATED (US) | 1992-08-18 | — | — | US | disclosed |