Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5952451 | 0.86 | ACHE (0.39) | DRD2DRD3LMNASMN1; SMN2MTNR1A | |
| SCHEMBL8874724 | 0.77 | CYP19A1 (0.33) | CYP19A1SMN1; SMN2HTR1ATDP1L3MBTL1 | |
| SCHEMBL8874258 | 0.77 | TDP1 (0.33) | CYP19A1HTR1ATDP1L3MBTL1 | |
| SCHEMBL27427131 | 0.77 | TDP1 (0.33) | CYP19A1HTR1ATDP1L3MBTL1 | |
| SCHEMBL5952581 | 0.77 | GRM2 (0.41) | DRD3LMNASMN1; SMN2MTNR1AMTNR1B | |
| SCHEMBL8756180 | 0.77 | CYP19A1 (0.58) | CYP19A1SMN1; SMN2HTR1A | |
| SCHEMBL5951765 | 0.73 | HTR2A (0.40) | LMNA | |
| SCHEMBL5952666 | 0.72 | HTR2A (0.37) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL6272342 | 0.72 | CYP19A1 (0.57) | CYP19A1SMN1; SMN2HTR1ATHRATHRB | |
| SCHEMBL27919093 | 0.71 | CYP19A1 (0.56) | CYP19A1SMN1; SMN2HTR1ATHRATHRB |
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-1057083-C | Tricyclic 1-aminoethylpyrrol derivative | HOFFMANN LA ROCHE (CH) | 2000-10-04 | — | — | CN | disclosed |