Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | HTR7 | P34969 | 2/20 | 0.50 |
| ▸ | HTR6 | P50406 | 2/20 | 0.50 |
| ▸ | DHFR | P00374 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.48 |
| ▸ | HTR3B | O95264 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11057555 | 0.84 | ALDH1A1 (0.44) | ALDH1A1LMNAMAPTSMN1; SMN2DHFR | |
| SCHEMBL11059926 | 0.83 | DHFR (0.49) | ALDH1A1LMNAMAPTSMN1; SMN2HTR7 | |
| SCHEMBL11054510 | 0.81 | DHFR (0.51) | ALDH1A1MAPTSMN1; SMN2HTR1ADHFR | |
| SCHEMBL11056014 | 0.81 | ADRB1 (0.49) | ALDH1A1LMNASMN1; SMN2HTR1AADRB1 | |
| SCHEMBL11058138 | 0.80 | DHFR (0.52) | ALDH1A1LMNAMAPTSMN1; SMN2HTR1A | |
| SCHEMBL11055216 | 0.78 | DRD4 (0.44) | ALDH1A1LMNAMAPTSMN1; SMN2HTR1A | |
| SCHEMBL6714846 | 0.76 | ALDH1A1 (0.75) | ALDH1A1LMNAMAPTALOX12SMN1; SMN2 | |
| SCHEMBL11100857 | 0.76 | ALDH1A1 (0.75) | ALDH1A1LMNAMAPTALOX12SMN1; SMN2 | |
| SCHEMBL11055227 | 0.75 | MAPT (0.49) | ALDH1A1LMNAMAPTSMN1; SMN2HTR1A | |
| SCHEMBL9646111 | 0.75 | ALDH1A1 (0.73) | ALDH1A1LMNAMAPTALOX12SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4425342-A | 1-(Substituted) piperazine-4-benzenesulfinamides, compositions and method of use | HOECHST-ROUSSEL PHARMACEUTICALS (US) | 1984-01-10 | — | — | US | claimed |
| US-4425342-A | 1-(Substituted) piperazine-4-benzenesulfinamides, compositions and method of use | HOECHST-ROUSSEL PHARMACEUTICALS (US) | 1984-01-10 | — | — | US | disclosed |
| EP-0017079-A1 | Benzenesulfinamides, a process for the preparation thereof and medicaments containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1980-10-15 | — | — | EP | disclosed |