Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 2/20 | 0.54 |
| ▸ | MAOB | P27338 | 7/20 | 0.53 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.51 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 2/20 | 0.48 |
| ▸ | TOP1 | P11387 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.45 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CTSV | O60911 | 1/20 | 0.45 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8613938 | 0.99 | GSTP1 (0.52) | GSTP1MAOBS1PR1S1PR3MAOA | |
| SCHEMBL8613447 | 0.96 | MAOB (0.55) | GSTP1MAOBS1PR1S1PR3MAOA | |
| SCHEMBL8618250 | 0.93 | MAOB (0.52) | GSTP1MAOBS1PR1S1PR3MAOA | |
| SCHEMBL8618461 | 0.93 | MAOB (0.52) | GSTP1MAOBS1PR1S1PR3MAOA | |
| SCHEMBL8616115 | 0.93 | GSTP1 (0.56) | GSTP1MAOBS1PR1S1PR3MAOA | |
| SCHEMBL8612999 | 0.93 | GSTP1 (0.56) | GSTP1MAOBS1PR1S1PR3MAOA | |
| SCHEMBL8615440 | 0.92 | GSTP1 (0.55) | GSTP1MAOBS1PR1S1PR3MCL1 | |
| SCHEMBL8617339 | 0.91 | GSTP1 (0.57) | GSTP1MAOBS1PR1S1PR3MAOA | |
| SCHEMBL8617910 | 0.90 | GSTP1 (0.56) | GSTP1MAOBS1PR1S1PR3MAOA | |
| SCHEMBL8614759 | 0.89 | GSTP1 (0.49) | GSTP1MAOBS1PR1S1PR3MAOA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0665836-B1 | BIFUNCTIONAL INTERMEDIATES FOR USE IN THE MANUFACTURE OF LIQUID CRYSTALS | HOECHST AG (DE) | 1998-04-29 | — | — | EP | disclosed |
| WO-1994010152-A1 | BIFUNCTIONAL INTERMEDIATES FOR USE IN THE MANUFACTURE OF LIQUID CRYSTALS | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-05-11 | — | — | WO | disclosed |