Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 13/20 | 0.48 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 9/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | TACR2 | P21452 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2003137 | 1.00 | PPARG (0.48) | PPARGPTGDR2PPARACYP2C9EGFR | |
| SCHEMBL2008720 | 0.90 | PLA2G2A (0.57) | PPARGPPARACYP2C9EGFRCHRM4 | |
| SCHEMBL2008718 | 0.90 | PLA2G2A (0.57) | PPARGPPARACYP2C9EGFRCHRM4 | |
| SCHEMBL2002441 | 0.86 | LMNA (0.54) | PPARGPTGDR2PPARACYP2C9EGFR | |
| SCHEMBL3002956 | 0.85 | PPARG (0.58) | PPARGPPARACYP2C9EGFRCHRM4 | |
| SCHEMBL3002958 | 0.85 | PPARG (0.58) | PPARGPPARACYP2C9EGFRCHRM4 | |
| SCHEMBL1998692 | 0.83 | PTGDR2 (0.68) | PPARGPTGDR2PPARACYP2C9EGFR | |
| SCHEMBL4055835 | 0.83 | PPARG (0.54) | PPARGPTGDR2PPARACYP2C9EGFR | |
| SCHEMBL2003789 | 0.80 | PPARG (0.53) | PPARGPTGDR2PPARACYP2C9EGFR | |
| SCHEMBL3009507 | 0.77 | PPARG (0.47) | PPARGPPARACYP2C9EGFRCHRM4 |
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-7960544-B2 | Useful indole compounds | IRONWOOD PHARMACEUTICALS, INC. (US) | 2011-06-14 | — | — | US | disclosed |