Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | IDH1 | O75874 | 1/20 | 0.43 |
| ▸ | CDC7 | O00311 | 1/20 | 0.43 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.40 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL4637999 | 0.90 | IDH1 (0.46) | CYP19A1SMN1; SMN2KDM4EALDH1A1IDH1 | |
| SCHEMBL4637752 | 0.89 | CYP19A1 (0.74) | CYP19A1SMN1; SMN2ALDH1A1HPGDMAPT | |
| SCHEMBL4639420 | 0.88 | CYP19A1 (0.60) | CYP19A1SMN1; SMN2KDM4EMAPTCACNA1B | |
| SCHEMBL4637742 | 0.86 | ALDH1A1 (0.52) | CYP19A1ALDH1A1HPGDIDH1GPBAR1 | |
| SCHEMBL4637771 | 0.83 | IDH1 (0.42) | CYP19A1ALDH1A1IDH1MAPTGPBAR1 | |
| SCHEMBL4637730 | 0.83 | MAPT (0.50) | CYP19A1SMN1; SMN2KDM4EALDH1A1IDH1 | |
| SCHEMBL4637772 | 0.83 | IDH1 (0.51) | CYP19A1SMN1; SMN2KDM4EALDH1A1IDH1 | |
| SCHEMBL4638568 | 0.82 | IDH1 (0.54) | CYP19A1SMN1; SMN2KDM4EIDH1 | |
| SCHEMBL5797387 | 0.80 | CYP19A1 (0.57) | CYP19A1SMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL6071984 | 0.80 | CYP19A1 (0.52) | CYP19A1SMN1; SMN2KDM4EALDH1A1MAPT |
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 |