Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | IDE | P14735 | 1/20 | 0.39 |
| ▸ | UBE2N | P61088 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9842029 | 0.89 | CA1 (0.40) | MITFTAAR1CA1CA2CA4 | |
| SCHEMBL9842210 | 0.76 | OPRD1 (0.38) | — | |
| SCHEMBL16846249 | 0.76 | SIGMAR1 (0.50) | MITFTAAR1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL9842276 | 0.76 | MITF (0.47) | MITFTAAR1TDP1HTR2AIDE | |
| SCHEMBL31541868 | 0.74 | SLC6A2 (0.43) | MITFTAAR1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL6619234 | 0.74 | MITF (0.52) | MITFTAAR1TDP1IDEUBE2N | |
| SCHEMBL10932480 | 0.74 | TAAR1 (0.39) | TAAR1SMN1; SMN2CA1CA2CA4 | |
| SCHEMBL2115137 | 0.73 | MITF (0.57) | MITFTAAR1ALDH1A1TDP1CA1 | |
| SCHEMBL4892854 | 0.73 | GRM2 (0.50) | MITFALDH1A1TSHRSMN1; SMN2HTR2A | |
| SCHEMBL9842320 | 0.72 | OPRD1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0461264-A1 | ETHYNYLPHENYL DERIVATIVE, PRODUCTION THEREOF, AND REMEDY FOR DISEASES OF CIRCULATORY ORGANS CONTAINING THE SAME AS ACTIVE INGREDIENT | KAKEN PHARMACEUTICAL CO., LTD. (JP) | 1991-12-18 | — | — | EP | disclosed |