Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.61 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | MLNR | O43193 | 1/20 | 0.61 |
| ▸ | MMP1 | P03956 | 1/20 | 0.61 |
| ▸ | MPO | P05164 | 1/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL6281034 | 0.82 | CYP19A1 (0.65) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| SCHEMBL8524769 | 0.81 | PTGS1 (0.50) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| SCHEMBL9574619 | 0.81 | SMN1; SMN2 (0.60) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| SCHEMBL8525177 | 0.81 | PTGS1 (0.50) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| SCHEMBL8942460 | 0.81 | MAPT (0.56) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| SCHEMBL8942347 | 0.80 | MAPT (0.55) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| SCHEMBL9561587 | 0.79 | SMN1; SMN2 (0.57) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| SCHEMBL8942431 | 0.79 | SMN1; SMN2 (0.54) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| Hydrochloric Acid SCHEMBL8942526 | 0.79 | MAPT (0.54) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 | |
| SCHEMBL8942209 | 0.77 | MAPT (0.53) | CYP19A1PTGS1PTGS2ADORA3CYP1A2 |
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-6004948-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION | NYCOMED AUSTRIA GMBH (AT) | 1999-12-21 | — | — | US | disclosed |