Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 3/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL3720155 | 0.80 | ADRB2 (0.46) | ADRB2ADRB1ESR1ESR2KMT2A | |
| SCHEMBL10642388 | 0.78 | SCN4A (0.50) | ADRB2ADRB1ESR1ESR2KMT2A | |
| SCHEMBL17676669 | 0.76 | KMT2A (0.43) | ADRB2ADRB1ESR1ESR2KMT2A | |
| SCHEMBL21999117 | 0.73 | NOS3 (0.49) | ADRB2KMT2AMEN1HTR1DHTR1B | |
| SCHEMBL3720970 | 0.71 | NQO1 (0.52) | ESR1ESR2TP53TDP1KDM4E | |
| SCHEMBL7600490 | 0.70 | ADRB2 (0.45) | ADRB2ADRB1ESR1ESR2THRA | |
| SCHEMBL15700176 | 0.70 | ESR1 (0.45) | ESR1ESR2THRATHRBTP53 | |
| SCHEMBL25797827 | 0.70 | PDIA6 (0.54) | ADRB2ESR1ESR2SMN1; SMN2THRA | |
| SCHEMBL25797832 | 0.70 | PDIA6 (0.54) | ADRB2ESR1ESR2SMN1; SMN2THRA | |
| SCHEMBL3720136 | 0.68 | PTGS1 (0.53) | ESR1ESR2KMT2AMEN1TP53 |
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-0062596-A1 | Derivatives of 4-aminoethoxy-5-isopropyl-2-methyl phenol, process for their preparation and their use as medicines | CORTIAL S.A. (FR) | 1982-10-13 | — | — | EP | claimed |