Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 7/20 | 0.55 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.55 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CRHR1 | P34998 | 5/20 | 0.47 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.46 |
| ▸ | GUSB | P08236 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20873066 | 0.80 | PRKCZ (0.64) | CYP11B2CYP11B1CYP17A1CYP3A4PRKCZ | |
| SCHEMBL23487649 | 0.75 | CYP11B2 (0.50) | CYP11B2CYP11B1CYP17A1CYP3A4PRKCZ | |
| SCHEMBL16212390 | 0.74 | MAP4K4 (0.46) | CYP11B2CYP11B1CYP17A1CYP3A4KDM4E | |
| SCHEMBL2328148 | 0.73 | GRM2 (0.45) | CYP11B2CYP11B1CYP17A1CYP3A4PRKCZ | |
| SCHEMBL27329478 | 0.73 | CYP11B1 (0.53) | CYP11B2CYP11B1CYP17A1CYP3A4PRKCZ | |
| SCHEMBL197273 | 0.72 | CYP2A6 (0.52) | CYP11B2CYP11B1CYP17A1CYP3A4PRKCZ | |
| SCHEMBL14830570 | 0.72 | CYP17A1 (0.69) | CYP11B2CYP11B1CYP17A1CYP3A4CYP1A2 | |
| SCHEMBL24569021 | 0.71 | ERN1 (0.48) | CYP11B2CYP11B1CYP17A1CYP3A4PRKCZ | |
| SCHEMBL14206720 | 0.71 | NOS1 (0.45) | CRHR1KDM4E | |
| SCHEMBL29624840 | 0.71 | AHR (0.64) | CYP3A4CRHR1KDM4EMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105163727-B | Stimulate neurogenetic isoquinilone derivatives | 豪夫迈·罗氏有限公司 | 2018-08-17 | — | — | CN | claimed |
| CN-105163727-B | Stimulate neurogenetic isoquinilone derivatives | 豪夫迈·罗氏有限公司 | 2018-08-17 | — | — | CN | disclosed |