Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.68 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.43 |
| ▸ | GCGR | P47871 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4639420 | 0.84 | CYP19A1 (0.60) | CYP19A1KMT2ASMN1; SMN2POLB | |
| SCHEMBL4639451 | 0.84 | CYP19A1 (0.48) | CYP19A1SMN1; SMN2POLBCYP2C9 | |
| SCHEMBL25333493 | 0.81 | CYP19A1 (0.56) | CYP19A1KMT2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL4638606 | 0.81 | CYP19A1 (0.56) | CYP19A1KMT2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL4638522 | 0.81 | CYP19A1 (0.44) | CYP19A1SMN1; SMN2POLBCYP1A2CYP2C9 | |
| SCHEMBL4637938 | 0.80 | CYP19A1 (0.55) | CYP19A1KMT2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL22816295 | 0.77 | CYP19A1 (0.77) | CYP19A1CA1CA2CA4CA9 | |
| SCHEMBL4637971 | 0.77 | CYP19A1 (0.50) | CYP19A1SMN1; SMN2CYP1A2 | |
| SCHEMBL22815805 | 0.76 | CYP19A1 (0.74) | CYP19A1CA1CA2CA4CA9 | |
| SCHEMBL4637752 | 0.74 | CYP19A1 (0.74) | CYP19A1KMT2ASMN1; SMN2POLBCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |
| EP-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |