Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 6/20 | 0.57 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.43 |
| ▸ | QPCT | Q16769 | 1/20 | 0.43 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.43 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7740291 | 0.83 | CYP11B1 (0.51) | CYP11B1CYP11B2CYP19A1CYP1A2CYP3A4 | |
| SCHEMBL570582 | 0.74 | CYP11B1 (1.00) | CYP11B1CYP11B2CYP19A1CYP1A2CYP3A4 | |
| SCHEMBL7737870 | 0.70 | CYP19A1 (0.67) | CYP11B1CYP11B2CYP19A1POLBTBXAS1 | |
| SCHEMBL11238973 | 0.69 | HMOX2 (0.64) | CYP11B1CYP11B2CYP19A1CYP1A2CYP3A4 | |
| SCHEMBL11012977 | 0.69 | CYP11B1 (0.66) | CYP11B1CYP19A1CYP3A4CYP2D6TBXAS1 | |
| Hydrochloric Acid SCHEMBL8073173 | 0.68 | NAPRT (0.83) | CYP19A1CYP1A2CYP3A4MAPTTBXAS1 | |
| SCHEMBL10389645 | 0.68 | NAPRT (0.56) | CYP11B1CYP11B2CYP19A1CYP1A2CYP3A4 | |
| SCHEMBL11020478 | 0.68 | CYP19A1 (0.63) | CYP11B1CYP11B2CYP19A1 | |
| SCHEMBL2729830 | 0.66 | CYP11B1 (1.00) | CYP11B1CYP11B2CYP19A1CYP1A2CYP3A4 | |
| SCHEMBL7463818 | 0.66 | CYP11B1 (0.60) | CYP11B1CYP11B2CYP19A1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE37781-E1 | VIRICIDES, PROTEASE INHIBITOR | DUPONT PHARMACEUTICALS COMPANY | 2002-07-02 | — | — | US | disclosed |