Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.35 |
| ▸ | KMO | O15229 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17625961 | 0.85 | AHR (0.45) | KDM4EALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL17626167 | 0.84 | IDO1 (0.43) | KDM4EALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL17626002 | 0.81 | KMO (0.40) | KDM4EALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL28053577 | 0.78 | CYP2D6 (0.37) | TAAR1PNMTHRH3CSNK2A1 | |
| SCHEMBL17626210 | 0.74 | KDM4E (0.44) | KDM4EALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL5558540 | 0.73 | TAAR1 (0.62) | TAAR1PNMTHRH3AHRCSNK2A1 | |
| SCHEMBL17626346 | 0.71 | AHR (0.43) | KDM4EALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL17626083 | 0.71 | AHR (0.39) | KDM4EALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL3174036 | 0.71 | AHR (0.46) | KDM4EALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL17625932 | 0.69 | AHR (0.37) | KDM4EBRAFAHRKMOMAPT |
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-105452248-A | Purine diones as WNT pathway modulators | AGENCY SCIENCE TECH & RES | 2016-03-30 | — | — | CN | disclosed |