Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31538069 | 1.00 | ESR1 (0.50) | ESR1TSHRACHECYP19A1ACP3 | |
| SCHEMBL21185370 | 0.87 | ESR1 (0.43) | ESR1TSHRACHECYP19A1ACP3 | |
| SCHEMBL13271101 | 0.87 | ESR1 (0.43) | ESR1TSHRACHECYP19A1ACP3 | |
| SCHEMBL15296272 | 0.87 | ESR1 (0.43) | ESR1TSHRACHECYP19A1ACP3 | |
| SCHEMBL27277950 | 0.87 | ESR1 (0.43) | ESR1TSHRACHECYP19A1ACP3 | |
| SCHEMBL27791697 | 0.87 | ESR1 (0.43) | ESR1TSHRACHECYP19A1ACP3 | |
| SCHEMBL6547004 | 0.85 | ESR1 (0.50) | ESR1TSHRACHECYP19A1ACP3 | |
| SCHEMBL8750454 | 0.85 | ESR1 (0.47) | ESR1TSHRACHECYP19A1ACP3 | |
| SCHEMBL9734906 | 0.84 | TSHR (0.48) | ESR1TSHRLMNA | |
| SCHEMBL23761614 | 0.83 | SLC6A2 (0.44) | ESR1TSHRACHECYP19A1CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5087784-A | Aromatic alkylation process and apparatus | AMOCO CORPORATION (US) | 1992-02-11 | — | — | US | claimed |
| US-5087784-A | Aromatic alkylation process and apparatus | AMOCO CORPORATION (US) | 1992-02-11 | — | — | US | disclosed |