Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | RGS12 | O14924 | 1/20 | 0.39 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.39 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | PTGFR | P43088 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1076574 | 0.87 | TSHR (0.50) | ALDH1A1TSHRHDAC1OPRM1DRD3 | |
| SCHEMBL504013 | 0.86 | ALDH1A1 (0.57) | ALDH1A1TSHRHDAC1OPRM1DRD3 | |
| SCHEMBL8905858 | 0.85 | ALDH1A1 (0.49) | ALDH1A1TSHRHDAC1OPRM1DRD3 | |
| SCHEMBL6916102 | 0.85 | ALDH1A1 (0.52) | ALDH1A1TSHROPRM1DRD3DRD2 | |
| SCHEMBL6761465 | 0.85 | ALDH1A1 (0.52) | ALDH1A1TSHRHDAC1OPRM1DRD3 | |
| Hydrogen Sulfide SCHEMBL27877649 | 0.84 | ALDH1A1 (0.55) | ALDH1A1TSHRHDAC1OPRM1DRD3 | |
| Hydrogen Sulfide SCHEMBL28874622 | 0.84 | ALDH1A1 (0.55) | ALDH1A1TSHRHDAC1OPRM1DRD3 | |
| SCHEMBL8784250 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TSHRHDAC1OPRM1DRD3 | |
| SCHEMBL8904807 | 0.84 | TSHR (0.47) | ALDH1A1TSHRHDAC1OPRM1DRD3 | |
| SCHEMBL27506956 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TSHRHDAC1OPRM1DRD3 |
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-4447600-A | IMMUNOSUPPRESSIVE AGENTS | KANTO ISHI PHARMACEUTICAL CO., LTD. (JP) | 1984-05-08 | — | — | US | disclosed |