Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.41 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 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 | |
|---|---|---|---|---|
| SCHEMBL15368851 | 0.85 | ESR1 (0.53) | ESR1ESR2LMNAKDM4EMAPK1 | |
| SCHEMBL3237146 | 0.81 | ESR1 (0.71) | ESR1ESR2SLC6A2CYP1A2CYP3A4 | |
| SCHEMBL22500213 | 0.81 | ESR1 (0.50) | ESR1ESR2LMNAKDM4EMAPK1 | |
| SCHEMBL6229525 | 0.79 | ESR1 (0.44) | ESR1ESR2CNR1CNR2IGF1R | |
| SCHEMBL3235488 | 0.79 | ESR1 (0.51) | ESR1ESR2LMNAKDM4EMAPK1 | |
| SCHEMBL22500212 | 0.78 | ESR1 (0.70) | ESR1ESR2LMNAKDM4EMAPK1 | |
| SCHEMBL984302 | 0.78 | ESR1 (0.74) | ESR1ESR2LMNAKDM4EADORA3 | |
| SCHEMBL5992041 | 0.76 | ESR1 (0.50) | ESR1ESR2LMNAKDM4EMAPK1 | |
| SCHEMBL3241376 | 0.76 | ESR1 (0.63) | ESR1ESR2KDM4ECA2PTGS2 | |
| SCHEMBL9497173 | 0.75 | ESR1 (0.53) | ESR1ESR2LMNAKDM4EMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010030787-A1 | ESTROGEN RECEPTOR LIGANDS | RADIUS HEALTH, INC. (US) | 2010-03-18 | — | — | WO | claimed |
| CN-102105475-A | Spiroaminodihydrothiazine derivatives | EISAI R&D MAN CO LTD | 2011-06-22 | — | — | CN | disclosed |
| WO-2010030787-A1 | ESTROGEN RECEPTOR LIGANDS | RADIUS HEALTH, INC. (US) | 2010-03-18 | — | — | WO | disclosed |
| WO-2010013794-A1 | SPIROAMINODIHYDROTHIAZINE DERIVATIVES | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-02-04 | — | — | WO | disclosed |