Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | TEK | Q02763 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.36 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4638522 | 0.88 | CYP19A1 (0.44) | CYP19A1P2RX7ALDH1A1TSHRNR1I3 | |
| SCHEMBL4637975 | 0.87 | CYP19A1 (0.39) | CYP19A1P2RX7ALDH1A1TSHRIDH1 | |
| SCHEMBL4637971 | 0.86 | CYP19A1 (0.50) | CYP19A1P2RX7ALDH1A1TSHRIDH1 | |
| SCHEMBL4637771 | 0.86 | IDH1 (0.42) | CYP19A1ALDH1A1IDH1KDRHCRTR1 | |
| SCHEMBL4638983 | 0.86 | IDH1 (0.49) | CYP19A1ALDH1A1TSHRIDH1 | |
| SCHEMBL4638860 | 0.84 | CYP19A1 (0.46) | CYP19A1P2RX7ALDH1A1TSHRIDH1 | |
| SCHEMBL4639523 | 0.83 | MAPT (0.46) | CYP19A1ALDH1A1IDH1L3MBTL1SMN1; SMN2 | |
| SCHEMBL4637939 | 0.78 | POLQ (0.42) | ALDH1A1IDH1KDR | |
| SCHEMBL4638893 | 0.76 | ABL1 (0.44) | ALDH1A1KDRSMN1; SMN2HCRTR1HCRTR2 | |
| SCHEMBL4638811 | 0.75 | IDH1 (0.40) | CYP19A1P2RX7ALDH1A1TSHRIDH1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |