Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | COMT | P21964 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | CCR3 | P51677 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7316968 | 0.88 | COMT (0.46) | COMTCA12CA1CA2CA9 | |
| SCHEMBL7326984 | 0.83 | CHRM1 (0.46) | CHRM1LMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL7327666 | 0.77 | CHRM1 (0.46) | CHRM1LMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL7360629 | 0.75 | CHRM1 (0.38) | CHRM1CA12CA1CA2CA9 | |
| SCHEMBL7325041 | 0.73 | ROCK2 (0.36) | CHRM1COMTLMNAALDH1A1 | |
| SCHEMBL7320742 | 0.73 | CHRM1 (0.42) | CHRM1COMTLMNAKMT2AALDH1A1 | |
| SCHEMBL4779943 | 0.72 | EBP (0.50) | CHRM1MEN1KMT2AALDH1A1HTT | |
| SCHEMBL7317797 | 0.72 | COMT (0.37) | CHRM1COMTCA12CA1CA2 | |
| SCHEMBL4730348 | 0.71 | CHRM1 (0.53) | CHRM1LMNAMEN1KMT2AMAPT | |
| SCHEMBL7329002 | 0.71 | COMT (0.52) | COMTCA12CA1CA2CA9 |
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-0287696-B1 | ISOQUINOLINE DERIVATIVES | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1991-01-02 | — | — | EP | disclosed |
| EP-0287696-A1 | Isoquinoline derivatives | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1988-10-26 | — | — | EP | disclosed |