Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.77 |
| ▸ | BCHE | P06276 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.45 |
| ▸ | CSF1R | P07333 | 1/20 | 0.44 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.44 |
| ▸ | NAPEPLD | Q6IQ20 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6922082 | 0.95 | ESR1 (0.73) | ESR1BCHEACHESIGMAR1HCRTR1 | |
| SCHEMBL6823204 | 0.94 | ESR1 (0.72) | ESR1BCHEACHESIGMAR1KDM4E | |
| SCHEMBL6922106 | 0.94 | ESR1 (0.72) | ESR1BCHEACHESIGMAR1HCRTR1 | |
| SCHEMBL6823739 | 0.91 | ESR1 (0.67) | ESR1BCHEACHESIGMAR1 | |
| SCHEMBL6819971 | 0.88 | ESR1 (0.63) | ESR1BCHEACHESIGMAR1KDM4E | |
| SCHEMBL6823595 | 0.86 | ESR1 (0.61) | ESR1BCHEACHESIGMAR1KDM4E | |
| SCHEMBL6823220 | 0.83 | ESR1 (0.77) | ESR1NPC1ALDH1A1MAPTCSF1R | |
| SCHEMBL6825957 | 0.83 | ESR1 (0.59) | ESR1SIGMAR1LMNAPAX8CSF1R | |
| SCHEMBL6825824 | 0.81 | NPC1 (0.61) | ESR1KDM4ENPC1ALDH1A1LMNA | |
| SCHEMBL6921522 | 0.80 | ESR1 (0.56) | ESR1SIGMAR1PAX8CSF1R |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004069820-A1 | COUMARIN DERIVATIVES HAVING AN AFFINITY FOR OESTROGEN RECEPTORS, METHOD FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | B.F.B. ETUDES ET RECHERCHES EXPERIMENTALES (FR) | 2004-08-19 | — | — | WO | disclosed |