Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.32 |
| ▸ | DRD3 | P35462 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10490482 | 0.85 | SOAT2 (0.42) | KCNH2MAPTSOAT2SOAT1 | |
| SCHEMBL10490478 | 0.85 | SOAT2 (0.42) | KCNH2MAPTSOAT2SOAT1 | |
| SCHEMBL9193487 | 0.81 | TSHR (0.37) | TSHRALDH1A1GLACHRM1SLC6A2 | |
| SCHEMBL9193492 | 0.81 | TSHR (0.37) | TSHRALDH1A1GLACHRM1SLC6A2 | |
| SCHEMBL18054856 | 0.77 | TSHR (0.39) | TSHRALDH1A1GLATDP1CHRM1 | |
| SCHEMBL28753986 | 0.74 | TSHR (0.56) | TSHRALDH1A1USP2HPGDTDP1 | |
| SCHEMBL26893189 | 0.73 | TSHR (0.42) | TSHRALDH1A1GLATDP1CHRM1 | |
| SCHEMBL20006912 | 0.71 | TSHR (0.41) | TSHRALDH1A1GLATDP1CHRM1 | |
| SCHEMBL24989854 | 0.69 | PPARG (0.40) | ALDH1A1USP2HPGDTDP1TLR8 | |
| SCHEMBL2443769 | 0.69 | TSHR (0.42) | TSHRALDH1A1GLATDP1CHRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0641309-A1 | SYNTHESIS OF VICINAL DIAMINES | MALLINCKRODT MEDICAL, INC. (US) | 1995-03-08 | — | — | EP | disclosed |
| WO-1993003003-A1 | SYNTHESIS OF VICINAL DIAMINES | MALLINCKRODT MEDICAL, INC. (US) | 1993-02-18 | — | — | WO | disclosed |