Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.34 |
| ▸ | CHRNG | P07510 | 1/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | CHRND | Q07001 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10000525 | 0.90 | ESR1 (0.66) | ESR1ESR2ALDH1A1GAACYP19A1 | |
| SCHEMBL13382522 | 0.86 | ESR1 (0.55) | ESR1ESR2ALDH1A1GAAMAOB | |
| SCHEMBL25986540 | 0.86 | ESR1 (0.60) | ESR1ESR2ALDH1A1GAACYP19A1 | |
| SCHEMBL12177591 | 0.83 | ESR2 (0.80) | ESR1ESR2ALDH1A1GAAMAOB | |
| SCHEMBL14518073 | 0.83 | ESR1 (0.46) | ESR1ESR2ALDH1A1GAACYP19A1 | |
| SCHEMBL14274358 | 0.83 | ESR1 (0.48) | ESR1ESR2ALDH1A1GAACYP19A1 | |
| SCHEMBL13508245 | 0.83 | ESR1 (0.48) | ESR1ESR2ALDH1A1GAACYP19A1 | |
| SCHEMBL17081749 | 0.80 | ESR1 (0.50) | ESR1ESR2ALDH1A1GAACYP19A1 | |
| SCHEMBL18230813 | 0.80 | PKM (0.51) | ESR1ESR2ALDH1A1GAAMAOB | |
| SCHEMBL22971495 | 0.79 | ESR1 (0.50) | ESR1ESR2ALDH1A1GAATSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2424018-A1 | Polyarylene block copolymer having sulfonic acid group and use thereof | JSR Corporation (JP) | 2012-02-29 | — | — | EP | disclosed |