Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3074106 | 0.87 | BCL2L1 (0.49) | SMN1; SMN2ESR1OPRD1ALDH1A1TP53 | |
| SCHEMBL3068540 | 0.87 | ESR1 (0.49) | SMN1; SMN2ESR1OPRD1ALDH1A1MEN1 | |
| SCHEMBL4620312 | 0.85 | ESR1 (0.38) | CYP2C9F2CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL3075044 | 0.85 | ESR1 (0.50) | HTR2AHTR2BSETD7LMNACHRM2 | |
| SCHEMBL4619153 | 0.84 | ESR1 (0.31) | ESR1ALDH1A1 | |
| SCHEMBL3133913 | 0.84 | ESR1 (0.34) | ESR1OPRD1ALDH1A1 | |
| SCHEMBL3073109 | 0.83 | KMT2A (0.39) | HTR2AHTR2BSETD7LMNACHRM2 | |
| SCHEMBL3073095 | 0.83 | TSHR (0.47) | HTR2AHTR2BSETD7LMNACHRM2 | |
| SCHEMBL3567124 | 0.80 | ALDH1A1 (0.40) | LMNASMN1; SMN2ESR1OPRD1ALDH1A1 | |
| SCHEMBL3069385 | 0.79 | TNFRSF1A (0.47) | ESR1MAPTHSD11B1 |
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-2005012220-A9 | CYCLOALKYLIDENE COMPOUNDS AS MODULATORS OF ESTROGEN RECEPTOR | SMITHKLINE BEECHAM CORP (US) | 2005-05-19 | — | — | WO | claimed |