Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 14/20 | 0.55 |
| ▸ | CYP11B2 | P19099 | 12/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 8/20 | 0.49 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | QPCT | Q16769 | 1/20 | 0.49 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.49 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1865702 | 0.77 | CYP11B1 (0.56) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL2729830 | 0.71 | CYP11B1 (1.00) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL7214592 | 0.70 | CYP11B1 (0.55) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL1024261 | 0.70 | CYP11B1 (0.84) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL13105237 | 0.69 | CYP11B1 (0.72) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL10525752 | 0.69 | HRH3 (0.46) | CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL1775141 | 0.69 | CYP11B1 (0.81) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL10525587 | 0.68 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7390727 | 0.67 | CYP11B1 (0.61) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL30523909 | 0.67 | CYP11B1 (0.76) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 |
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-100372849-C | Pyrrolopyrimidines as cysteine protease inhibitors | NOVARTIS AG (CH) | 2008-03-05 | — | — | CN | disclosed |
| CN-1549817-A | Pyrrolo pyrimidines, process for their preparation, their use and pharmaceutical compositions containing them | ��˹��ŵ�� | 2004-11-24 | — | — | CN | disclosed |