Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 8/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.55 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.53 |
| ▸ | HTR1A | P08908 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7328052 | 0.88 | ADRB2 (0.59) | ADRB2CYP1A2ADRB1ADRB3MEN1 | |
| SCHEMBL9647989 | 0.88 | ADRB2 (0.56) | ADRB2CYP1A2ADRB1ADRB3MEN1 | |
| SCHEMBL10562386 | 0.86 | ADRB2 (0.54) | ADRB2CYP1A2ADRB1ADRB3MEN1 | |
| Benzoic Acid SCHEMBL9647080 | 0.85 | ADRB2 (0.53) | ADRB2CYP1A2ADRB1ADRB3MEN1 | |
| SCHEMBL6451228 | 0.84 | HTR1A (0.72) | ADRB2CYP1A2ADRB1ADRB3MEN1 | |
| SCHEMBL9518687 | 0.83 | MEN1 (0.64) | ADRB2CYP1A2ADRB1ADRB3MEN1 | |
| SCHEMBL10572537 | 0.83 | HTR1A (0.47) | ADRB2ADRB1ADRB3HTR1ADRD4 | |
| SCHEMBL7333097 | 0.82 | ADRB2 (0.57) | ADRB2CYP1A2ADRB1ADRB3MEN1 | |
| SCHEMBL9646944 | 0.80 | ADRB2 (0.56) | ADRB2CYP1A2ADRB1ADRB3MEN1 | |
| SCHEMBL9131862 | 0.79 | ADRB2 (0.53) | ADRB2CYP1A2ADRB1ADRB3MEN1 |
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-0209435-B1 | Hydroxyalkoxy-4-phenylpropyl indole derivatives, their salts, process and intermediates for their preparation, use as medicines and compositions containing them | ROUSSEL UCLAF (FR) | 1993-11-24 | — | — | EP | claimed |