Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CARM1 | Q86X55 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 3/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | PPARD | Q03181 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | PDIA6 | Q15084 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16955559 | 0.86 | NQO1 (0.45) | CARM1NPSR1KDM4EKMT2ACYP3A4 | |
| SCHEMBL6705679 | 0.84 | ESR1 (0.54) | NPSR1PPARGPPARAPPARDKDM4E | |
| SCHEMBL30630148 | 0.84 | ESR1 (0.54) | NPSR1PPARGPPARAPPARDKDM4E | |
| SCHEMBL16606251 | 0.80 | ALDH1A1 (0.46) | KDM4ELMNAGAAKMT2AMAPT | |
| SCHEMBL14015789 | 0.79 | ESR1 (0.55) | PPARGPPARAPPARDESR1PDIA6 | |
| SCHEMBL11244540 | 0.79 | ESR1 (0.55) | PPARGPPARAPPARDESR1PDIA6 | |
| SCHEMBL14015794 | 0.79 | ESR1 (0.55) | PPARGPPARAPPARDESR1PDIA6 | |
| SCHEMBL12313586 | 0.78 | INPPL1 (0.49) | CARM1NPSR1PPARGPPARAPPARD | |
| SCHEMBL28832127 | 0.77 | PPARG (0.47) | PPARGPPARAPPARDKDM4EESR1 | |
| SCHEMBL1911936 | 0.77 | CA12 (0.48) | NPSR1KDM4EGAAKMT2ATHRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-104968337-A | Formulation comprising benzothiazolone compound | NOVARTIS AG | 2015-10-07 | — | — | CN | disclosed |