Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 10/20 | 0.44 |
| ▸ | THRA | P10827 | 4/20 | 0.34 |
| ▸ | THRB | P10828 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL3202467 | 0.73 | MAPK1 (0.60) | MAPT | |
| SCHEMBL28044393 | 0.72 | PTPN1 (0.39) | HCAR2ALDH1A1 | |
| SCHEMBL4847161 | 0.71 | HCAR2 (0.43) | HCAR2ALDH1A1GABRR1CYP3A4GABRA1 | |
| Hydrochloric Acid SCHEMBL1374074 | 0.69 | ALDH1A1 (0.43) | HCAR2ALDH1A1GABRR1CYP3A4GABRA1 | |
| SCHEMBL3261435 | 0.69 | SMN1; SMN2 (0.51) | HCAR2ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL3342094 | 0.69 | HCAR2 (0.46) | HCAR2ALDH1A1GABRR1CYP3A4GABRA1 | |
| SCHEMBL27864493 | 0.68 | HCAR2 (0.53) | HCAR2ALDH1A1GABRR1CYP3A4GABRA1 | |
| SCHEMBL27633319 | 0.68 | HCAR2 (0.49) | HCAR2THRATHRBALDH1A1GABRR1 | |
| SCHEMBL12767758 | 0.68 | HCAR2 (0.48) | HCAR2THRATHRBALDH1A1CYP3A4 | |
| SCHEMBL1346490 | 0.67 | HCAR2 (0.44) | HCAR2ALDH1A1GABRR1CYP3A4GABRA1 |
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-105263932-A | Heterocyclic compound | TAKEDA PHARMACEUTICAL | 2016-01-20 | — | — | CN | disclosed |