Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL29104732 | 0.89 | CA1 (0.41) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL8763566 | 0.83 | ALDH1A1 (0.43) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL778058 | 0.82 | CA1 (0.36) | ALDH1A1HSD11B1CA1CA2CA12 | |
| SCHEMBL656155 | 0.82 | PTGS2 (0.42) | ALDH1A1SMN1; SMN2CA1CA2CA12 | |
| SCHEMBL8788235 | 0.80 | CYP2D6 (0.37) | ALDH1A1HSD11B1CA1CA2CA12 | |
| SCHEMBL8089603 | 0.78 | MEN1 (0.38) | ALDH1A1SMN1; SMN2SCN9ACA1CA2 | |
| SCHEMBL6942861 | 0.77 | JAK2 (0.44) | CA1CA2CA12CA7CA14 | |
| SCHEMBL9099567 | 0.75 | SCN9A (0.38) | ALDH1A1SCN9AHSD11B1GAAMAPT | |
| SCHEMBL27009904 | 0.75 | CHRM5 (0.37) | ALDH1A1GAAMAPTLMNATP53 | |
| SCHEMBL2486113 | 0.74 | TSHR (0.35) | ALDH1A1SMN1; SMN2CA1CA2CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-5489501-A | MIXTURES OF TWO COORDINATION COMPOUNDS WHICH REACT TO FORM NEW COORDINATION COMPOUND WHILE CAUSING VISIBLE COLOR CHANGES | RICOH COMPANY, LTD. (JP) | 1996-02-06 | — | — | US | disclosed |
| US-5446011-A | Imagewise coloring when heating; mixture of n-substituted indole, aromatic polyhydroxy compound, carbonyl compound and an acid | RICOH COMPANY, LTD. (JP) | 1995-08-29 | — | — | US | disclosed |