Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 5/20 | 0.39 |
| ▸ | EDNRB | P24530 | 2/20 | 0.35 |
| ▸ | EDNRA | P25101 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.30 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7772520 | 0.86 | KIF11 (0.43) | KIF11SMN1; SMN2ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL7764655 | 0.85 | KIF11 (0.45) | KIF11SMN1; SMN2LMNA | |
| SCHEMBL7764620 | 0.80 | KIF11 (0.40) | KIF11EDNRBEDNRAKDM4EALDH1A1 | |
| SCHEMBL7770270 | 0.80 | KIF11 (0.41) | KIF11 | |
| SCHEMBL7772500 | 0.72 | LMNA (0.40) | KIF11KDM4ECYP2D6LMNAMAOA | |
| SCHEMBL6322832 | 0.69 | ADRB2 (0.54) | ALDH1A1CYP2D6SLC6A2 | |
| SCHEMBL6322160 | 0.69 | SIGMAR1 (0.36) | KIF11KDM4ESMN1; SMN2ALDH1A1CYP2D6 | |
| SCHEMBL6322829 | 0.69 | ADRB2 (0.54) | ALDH1A1CYP2D6SLC6A2 | |
| SCHEMBL6322158 | 0.69 | SIGMAR1 (0.36) | KIF11KDM4ESMN1; SMN2ALDH1A1CYP2D6 | |
| SCHEMBL11622889 | 0.68 | KIF11 (0.47) | KIF11SMN1; SMN2CYP2C19 |
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-1107944-A1 | AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA 3 ADRENERGIC AGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-06-20 | — | — | EP | disclosed |
| WO-2000012462-A1 | AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA 3 ADRENERGIC AGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-03-09 | — | — | WO | disclosed |