Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 14/20 | 0.61 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.38 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.37 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | PTGIS | Q16647 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10975948 | 0.99 | CYP19A1 (0.60) | CYP19A1CYP11B2TBXAS1PTGER3PTGER2 | |
| Hydrochloric Acid SCHEMBL10976473 | 0.99 | CYP19A1 (0.60) | CYP19A1CYP11B2TBXAS1PTGER3PTGER2 | |
| SCHEMBL10974976 | 0.99 | CYP19A1 (0.60) | CYP19A1CYP11B2TBXAS1PTGER3PTGER2 | |
| Hydrochloric Acid SCHEMBL10973284 | 0.97 | CYP19A1 (0.58) | CYP19A1CYP11B2TBXAS1PTGER3PTGER2 | |
| Hydrochloric Acid SCHEMBL11065811 | 0.97 | CYP19A1 (0.58) | CYP19A1CYP11B2TBXAS1PTGER3PTGER2 | |
| SCHEMBL11448858 | 0.75 | CYP19A1 (0.58) | CYP19A1CYP11B2CYP11B1KCNH2 | |
| SCHEMBL12978419 | 0.72 | CYP19A1 (0.58) | CYP19A1CYP11B2CYP11B1KCNH2 | |
| SCHEMBL9041549 | 0.67 | PTGER3 (0.43) | PTGER3PTGER2 | |
| SCHEMBL5429399 | 0.64 | CYP11B2 (0.43) | CYP19A1CYP11B2CYP11B1KCNH2 | |
| SCHEMBL26211648 | 0.63 | CYP1A2 (0.43) | — |
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-4444775-A | ENZYME INHIBITORS | CIBA-GEIGY CORPORATION (US) | 1984-04-24 | — | — | US | claimed |