Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 8/20 | 0.46 |
| ▸ | CHUK | O15111 | 5/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.41 |
| ▸ | CYP21A2 | P08686 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.35 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.35 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.35 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.35 |
| ▸ | CACNA2D1 | P54289 | 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 | |
|---|---|---|---|---|
| SCHEMBL13087858 | 0.91 | IKBKB (0.48) | IKBKBCHUKCYP11B1SMN1; SMN2TDO2 | |
| SCHEMBL13087672 | 0.90 | IKBKB (0.58) | IKBKBCHUKCYP17A1CYP21A2CYP3A4 | |
| SCHEMBL13087965 | 0.89 | IKBKB (0.54) | IKBKBCHUKCYP17A1CYP21A2CYP3A4 | |
| SCHEMBL13087967 | 0.89 | IKBKB (0.48) | IKBKBCHUKNAMPTNAAACACNB4 | |
| SCHEMBL13088200 | 0.89 | IKBKB (0.46) | IKBKBCHUKCYP17A1CYP21A2CYP11B1 | |
| SCHEMBL13087958 | 0.88 | IKBKB (0.48) | IKBKBCHUKCYP19A1CYP11B1NAMPT | |
| SCHEMBL13087957 | 0.87 | IKBKB (0.47) | IKBKBCHUKCYP17A1CYP21A2CYP3A4 | |
| SCHEMBL13088201 | 0.87 | IKBKB (0.49) | IKBKBCHUKCYP11B1NAMPTSMN1; SMN2 | |
| SCHEMBL13088204 | 0.86 | IKBKB (0.48) | IKBKBCHUKCYP17A1CYP21A2NAMPT | |
| SCHEMBL13087830 | 0.86 | IKBKB (0.48) | IKBKBCHUKCYP17A1CYP21A2NAMPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8299055-B2 | 8-substituted isoquinoline derivative and the use thereof | ASAHI KASEI PHARMA CORPORATION (JP) | 2012-10-30 | — | — | US | disclosed |
| US-8299055-B2 | 8-substituted isoquinoline derivative and the use thereof | ASAHI KASEI PHARMA CORPORATION (JP) | 2012-10-30 | — | — | US | disclosed |
| US-20100261701-A1 | 8-Substituted isoquinoline derivative and the use thereof | ASAHI KASEI PHARMA CORPORATION (JP) | 2010-10-14 | — | — | US | disclosed |
| US-20100261701-A1 | 8-Substituted isoquinoline derivative and the use thereof | ASAHI KASEI PHARMA CORPORATION (JP) | 2010-10-14 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100261701-A1 | 8-Substituted isoquinoline derivative and the use thereof | RELA, NFKBIA, NFKB2 | IKBKB 7/4885CHUK 17/4885CYP17A1 777/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.