Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | TACR2 | P21452 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SHBG | P04278 | 1/20 | 0.47 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | TST | Q16762 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10806538 | 0.82 | ESR1 (0.39) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL14686036 | 0.80 | TYR (0.54) | TP53CYP3A4KDM4EALDH1A1HSD17B10 | |
| SCHEMBL11230398 | 0.79 | S1PR1 (0.56) | S1PR1S1PR3TLR8 | |
| SCHEMBL9580333 | 0.78 | ESR1 (0.46) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL9418140 | 0.78 | ESR1 (0.40) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL17107159 | 0.75 | CYP1A2 (0.47) | KDM4EALDH1A1LMNAMEN1MAPT | |
| SCHEMBL26059358 | 0.75 | CYP3A4 (0.57) | TP53CYP3A4KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5539606 | 0.74 | IDH1 (0.48) | ESR1ESR2TYRTLR8 | |
| SCHEMBL626232 | 0.72 | ESR1 (0.69) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL15345397 | 0.72 | TLR8 (0.53) | S1PR1S1PR3TLR8 |
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-0160508-B1 | PHENOL DERIVATIVES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-05-31 | — | — | EP | claimed |