Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I3 | Q14994 | 1/20 | 0.68 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.56 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.56 |
| ▸ | GRIN1 | Q05586 | 6/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.51 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.45 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.42 |
| ▸ | SHBG | P04278 | 1/20 | 0.42 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL5842846 | 0.83 | CDK5 (0.57) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL5842843 | 0.83 | CDK5 (0.57) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL28142697 | 0.83 | CDK5 (0.57) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL31315001 | 0.82 | CDK5 (0.56) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL21206237 | 0.82 | CDK5 (0.68) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL21206146 | 0.82 | CDK5 (0.68) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL16385901 | 0.82 | CDK5 (0.68) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL14883710 | 0.82 | CDK5 (0.68) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL4442143 | 0.81 | NR1I3 (0.59) | NR1I3CDK5CDK5R1GRIN1GRIN2B | |
| SCHEMBL20781172 | 0.81 | NR1I3 (1.00) | NR1I3CDK5CDK5R1GRIN1GRIN2B |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115389648-A | Method for detecting multiple steroid hormones in biological body fluid | 上海体育学院 | 2022-11-25 | — | — | CN | disclosed |
| CN-108822175-A | 3,16- androstenedione class compound and its application | 昆明理工大学 | 2018-11-16 | — | — | CN | disclosed |
| CN-106749463-A | A kind of method that methyltestosterone is reclaimed in the mother liquor from methyltestosterone | 华中药业股份有限公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-106589032-A | Treatment method for methyltestosterone mother liquor | 华中药业股份有限公司 | 2017-04-26 | — | — | CN | disclosed |
| CN-106163528-A | Steroids for the treatment of hepatic encephalopathy | 梅克芳识别有限公司 | 2016-11-23 | — | — | CN | disclosed |