Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.69 |
| ▸ | GRM4 | Q14833 | 6/20 | 0.63 |
| ▸ | FADS1 | O60427 | 3/20 | 0.59 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.55 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | CSF1R | P07333 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29882003 | 0.87 | TRPA1 (0.75) | TRPA1GRM4FADS1ADRA2AAURKA | |
| SCHEMBL4741513 | 0.87 | TRPA1 (0.75) | TRPA1GRM4FADS1ADRA2AAURKA | |
| SCHEMBL29592533 | 0.81 | TRPA1 (0.71) | TRPA1GRM4FADS1ADRA2AMAPK10 | |
| SCHEMBL27604456 | 0.81 | TRPA1 (0.71) | TRPA1GRM4FADS1ADRA2AHPGD | |
| SCHEMBL4822088 | 0.81 | TRPA1 (0.71) | TRPA1GRM4FADS1ADRA2AAURKA | |
| SCHEMBL19794595 | 0.78 | GRM4 (1.00) | TRPA1GRM4FADS1ADRA2ACYP3A4 | |
| SCHEMBL18274872 | 0.77 | TRPA1 (0.57) | TRPA1GRM4FADS1ADRA2AAURKA | |
| SCHEMBL31032755 | 0.76 | TRPA1 (0.54) | TRPA1GRM4FADS1ADRA2AAURKA | |
| SCHEMBL11756891 | 0.76 | TRPA1 (0.54) | TRPA1GRM4FADS1ADRA2AAURKA | |
| SCHEMBL12510676 | 0.75 | TRPA1 (0.54) | TRPA1GRM4FADS1ADRA2ALRRK2 |
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-0509402-B1 | Substituted 3-(Pyridinylamino)-indoles and benzo[b]thiophenes, a process for their preparation and their use as medicaments | HOECHST MARION ROUSSEL INC (US) | 1998-01-07 | — | — | EP | disclosed |
| US-5177088-A | Cognition Activators | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1993-01-05 | — | — | US | disclosed |
| EP-0509402-A1 | Substituted 3-(Pyridinylamino)-indoles and benzo[b]thiophenes, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1992-10-21 | — | — | EP | disclosed |