Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | GPR3 | P46089 | 1/20 | 0.30 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
| ▸ | MMP7 | P09237 | 1/20 | 0.30 |
| ▸ | MMP9 | P14780 | 1/20 | 0.30 |
| ▸ | MMP8 | P22894 | 1/20 | 0.30 |
| ▸ | MMP14 | P50281 | 1/20 | 0.30 |
| ▸ | STAT3 | P40763 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27617674 | 0.91 | CYP1A2 (0.32) | ESR1CA2MAPK1 | |
| SCHEMBL27636716 | 0.90 | CTSK (0.34) | ESR1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL27636782 | 0.89 | ALDH1A1 (0.36) | ESR1KMT2AALDH1A1LMNAMAPK1 | |
| SCHEMBL28754639 | 0.86 | ESR1 (0.39) | ESR1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL27617668 | 0.86 | GPR3 (0.40) | ESR1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL27637144 | 0.85 | ESR1 (0.33) | ESR1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL27636697 | 0.85 | PTPRC (0.35) | — | |
| SCHEMBL27617676 | 0.82 | ALDH1A1 (0.32) | ESR1CA2ALDH1A1LMNATSHR | |
| SCHEMBL28757641 | 0.81 | ESR1 (0.35) | ESR1 | |
| SCHEMBL27617898 | 0.80 | ESR1 (0.34) | ESR1PSEN1PSEN2APH1BNCSTN |
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 |
|---|---|---|---|---|---|---|---|
| CN-1720231-A | Substituted dihydrophenanthridinesulfonamides | WYETH CORP (US) | 2006-01-11 | — | — | CN | disclosed |