Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 11/20 | 0.60 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.58 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.58 |
| ▸ | ADRB3 | P13945 | 7/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | DRD4 | P21917 | 1/20 | 0.58 |
| ▸ | HTR1B | P28222 | 1/20 | 0.58 |
| ▸ | HTR2C | P28335 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL7641388 | 0.90 | HTR1A (0.61) | HTR1AADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL6322237 | 0.89 | ADRB3 (0.65) | HTR1AADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL6056296 | 0.81 | HTR1A (0.71) | HTR1AADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL7296138 | 0.81 | ADRB3 (0.78) | ADRB2ADRB1ADRB3 | |
| SCHEMBL7288262 | 0.79 | ADRB3 (0.69) | HTR1AADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL7297780 | 0.78 | ADRB3 (0.68) | HTR1AADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL4845543 | 0.78 | HTR1A (0.76) | HTR1AADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL7367227 | 0.78 | HTR1A (0.61) | HTR1AADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL7296273 | 0.77 | ADRB3 (0.67) | HTR1AADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL7285328 | 0.77 | ADRB3 (0.67) | HTR1AADRB2ADRB1ADRB3CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1230210-A1 | AMINOALCOHOL DERIVATIVES USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-08-14 | — | — | EP | disclosed |
| WO-2001036375-A1 | AMINOALCOHOL DERIVATIVES USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-05-25 | — | — | WO | disclosed |