Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 4/20 | 0.34 |
| ▸ | HTR2C | P28335 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | CCNC | P24863 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3839247 | 0.97 | PPARG (0.35) | PPARGHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL3835938 | 0.86 | PPARG (0.41) | PPARGKDM4EALDH1A1PTGS1PTGS2 | |
| SCHEMBL3835082 | 0.84 | HTR2A (0.39) | HTR2AHTR2CKDM4EALDH1A1LMNA | |
| SCHEMBL3835919 | 0.77 | HTR2A (0.41) | HTR2AHTR2CPTGS1PTGS2KDR | |
| SCHEMBL3839475 | 0.74 | TUBB4A (0.46) | PPARGHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL2344940 | 0.73 | ALDH1A1 (0.42) | KDM4EALDH1A1HSD17B10PTGS1PTGS2 | |
| SCHEMBL2344225 | 0.72 | ALDH1A1 (0.43) | KDM4EALDH1A1NPC1RAB9APTGS1 | |
| SCHEMBL3837549 | 0.70 | TUBB4A (0.38) | PPARGHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL3839514 | 0.67 | TUBB4A (0.36) | PPARGHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL4153660 | 0.62 | ALDH1A1 (0.43) | KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1791537-B1 | 3-ARYLTHIOINDOLE-2-CARBOXAMIDE DERIVATIVES AND ANALOGS THEREOF AS INHIBITORS OF CASEIN KINASE I | AVENTIS PHARMA INC (US) | 2009-10-14 | — | — | EP | claimed |