Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.44 |
| ▸ | QPCT | Q16769 | 1/20 | 0.44 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.44 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28080889 | 0.83 | GSTP1 (0.55) | L3MBTL1CYP19A1MAPTCYP1A2CYP2C19 | |
| SCHEMBL6141108 | 0.78 | SLC6A3 (0.44) | L3MBTL1MAPTPOLBSIGMAR1KDM4E | |
| SCHEMBL3725873 | 0.74 | HPGD (0.46) | HPGDSCYP19A1CYP11B1CYP11B2CYP3A4 | |
| SCHEMBL5490865 | 0.74 | CYP19A1 (0.45) | HPGDSL3MBTL1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL28196405 | 0.74 | CYP11B1 (0.53) | HPGDSL3MBTL1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL31212412 | 0.73 | CYP19A1 (0.44) | HPGDSCYP19A1CYP11B1CYP11B2CYP3A4 | |
| SCHEMBL35352 | 0.70 | CYP19A1 (0.56) | L3MBTL1CYP19A1CYP11B1CYP11B2CYP3A4 | |
| SCHEMBL1346083 | 0.70 | HPGDS (0.77) | HPGDSCYP19A1CYP3A4CYP2D6MAPT | |
| SCHEMBL9603290 | 0.70 | TSHR (0.41) | HPGDSCYP19A1CYP11B1CYP11B2CYP3A4 | |
| SCHEMBL13357769 | 0.70 | SIGMAR1 (0.46) | CYP19A1CYP11B1CYP11B2CYP3A4CYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103804108-B | A kind of method preparing primary amine | 沈阳药科大学 | 2016-08-03 | — | — | CN | disclosed |