Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.54 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.48 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.48 |
| ▸ | PTGFR | P43088 | 1/20 | 0.48 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.48 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.48 |
| ▸ | PTGIR | P43119 | 1/20 | 0.48 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.48 |
| ▸ | APEX1 | P27695 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.46 |
| ▸ | PTPRG | P23470 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11543540 | 0.85 | ALDH1A1 (0.48) | ANO1CA1CA2ALDH1A1HTT | |
| SCHEMBL11545937 | 0.82 | CAPN1 (0.52) | CA1CA2ALDH1A1HTTTSHR | |
| SCHEMBL11542230 | 0.81 | ALDH1A1 (0.49) | ANO1CA1CA2SLC6A5ALDH1A1 | |
| SCHEMBL11544239 | 0.77 | HPGD (0.50) | ANO1ALDH1A1HTTTSHRMEN1 | |
| SCHEMBL3461063 | 0.77 | TBXA2R (0.55) | SLC6A2SLC6A4SLC6A3TBXA2RPTGER1 | |
| SCHEMBL11542176 | 0.77 | ALDH1A1 (0.46) | SLC6A5ALDH1A1HTT | |
| SCHEMBL11544300 | 0.77 | KDM4E (0.48) | ANO1ALDH1A1MEN1KMT2A | |
| SCHEMBL13669850 | 0.75 | MAPT (0.51) | POLBALDH1A1HTTTSHRMEN1 | |
| SCHEMBL28577924 | 0.74 | LMNA (0.56) | POLBALDH1A1HTTTSHRMEN1 | |
| SCHEMBL30431941 | 0.73 | ALDH1A1 (0.69) | APEX1POLBALDH1A1HTTTSHR |
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-4175191-A | 4-Phenyl isoquinolines | SANDOZ, INC. (US) | 1979-11-20 | — | — | US | disclosed |
| US-3989704-A | 3-Substituted-4-aryl isoquinolines | SANDOZ, INC. (US) | 1976-11-02 | — | — | US | disclosed |