Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 15/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 9/20 | 0.51 |
| ▸ | CASP1 | P29466 | 8/20 | 0.51 |
| ▸ | CASP7 | P55210 | 7/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | USP2 | O75604 | 8/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.49 |
| ▸ | TSHR | P16473 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | GLA | P06280 | 2/20 | 0.49 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.47 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCND1 | P24385 | 1/20 | 0.36 |
| ▸ | CCND2 | P30279 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21429505 | 1.00 | CYP1A2 (0.51) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL30828539 | 0.89 | CYP1A2 (0.41) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL17813507 | 0.81 | CYP1A2 (0.53) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL30194234 | 0.79 | CYP1A2 (0.41) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL21428628 | 0.79 | CYP1A2 (0.41) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL31532070 | 0.77 | CYP1A2 (0.61) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL31532069 | 0.77 | CYP1A2 (0.61) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL18544265 | 0.77 | CYP1A2 (0.60) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL5364876 | 0.74 | CDK4 (0.43) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 | |
| SCHEMBL4141389 | 0.73 | CYP1A2 (0.36) | CYP1A2ALDH1A1HSD17B10CASP1CASP7 |
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-117794939-A | Antibiotic pyrazinothiazine derivatives and process for their preparation | 巴格沃克斯研究印度私人有限公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-112218862-B | Oxazolidinone antibiotic compounds and process for preparing same | 巴格沃克斯研究有限公司 | 2024-01-02 | — | — | CN | disclosed |