Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7487183 | 0.92 | ADRB2 (0.46) | ADRB2ADRB1HTR1AADRB3TSHR | |
| SCHEMBL29993176 | 0.80 | ADRB2 (0.43) | ADRB2ADRB1HTR1AADRB3TSHR | |
| SCHEMBL1660912 | 0.80 | ADRB2 (0.43) | ADRB2ADRB1HTR1AADRB3TSHR | |
| SCHEMBL7483555 | 0.79 | CYP2A6 (0.38) | GRM5GRM1BACE1 | |
| SCHEMBL7717820 | 0.74 | RXRA (0.33) | MRGPRX4BACE1 | |
| SCHEMBL7779781 | 0.74 | ALDH1A1 (0.37) | HTR1AALDH1A1KDM4EHPGDGAA | |
| SCHEMBL7776665 | 0.73 | SIGMAR1 (0.41) | SIGMAR1ABCB1 | |
| SCHEMBL7486506 | 0.73 | GRM5 (0.30) | GRM5GRM1 | |
| SCHEMBL5155831 | 0.72 | ALDH1A1 (0.43) | HTR1AALDH1A1KDM4EHTTMEN1 | |
| SCHEMBL29588862 | 0.72 | ADRB2 (0.52) | ADRB2ADRB1HTR1AADRB3TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007003378-A2 | CATALYST | BOREALIS TECHNOLOGY OY (FI) | 2007-01-11 | — | — | WO | disclosed |
| EP-1739103-A1 | Catalyst | Borealis Technology Oy (FI) | 2007-01-03 | — | — | EP | disclosed |