Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | FDPS | P14324 | 2/20 | 0.36 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | QPCT | Q16769 | 1/20 | 0.35 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.35 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.35 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | GGPS1 | O95749 | 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 | |
|---|---|---|---|---|
| SCHEMBL2835661 | 0.81 | TBXAS1 (0.52) | TBXAS1ALDH1A1CYP11B1CYP11B2CYP19A1 | |
| SCHEMBL26079402 | 0.74 | — | — | |
| SCHEMBL23928779 | 0.74 | — | — | |
| SCHEMBL422099 | 0.73 | CYP11B1 (0.50) | TBXAS1L3MBTL1NOS1ALDH1A1CYP11B1 | |
| SCHEMBL28260553 | 0.71 | ALDH1A1 (0.42) | TBXAS1L3MBTL1ALDH1A1CYP11B1CYP11B2 | |
| SCHEMBL6668513 | 0.71 | QPCT (0.49) | TBXAS1ALDH1A1CYP11B1CYP11B2CYP19A1 | |
| SCHEMBL7812182 | 0.69 | — | — | |
| SCHEMBL8191732 | 0.68 | — | — | |
| SCHEMBL10903412 | 0.67 | TBXAS1 (0.58) | TBXAS1ALDH1A1CYP19A1CYP1A2CYP3A4 | |
| SCHEMBL6125402 | 0.65 | — | — |
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-107312012-A | Pyrimido phenodiazine * analog derivatives and its medical usage | 北京师范大学 | 2017-11-03 | — | — | CN | disclosed |