Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3447796 | 1.00 | HSD11B1 (0.40) | HSD11B1HRH2HRH1SMYD3GAA | |
| Hydrochloric Acid SCHEMBL3447798 | 0.98 | HSD11B1 (0.40) | HSD11B1HRH2HRH1SMYD3GAA | |
| Hydrochloric Acid SCHEMBL3447794 | 0.98 | HSD11B1 (0.40) | HSD11B1HRH2HRH1SMYD3GAA | |
| SCHEMBL29042818 | 0.90 | KDM4E (0.44) | HSD11B1SMYD3GAATDP1KDM4E | |
| SCHEMBL2925781 | 0.90 | KDM4E (0.44) | HSD11B1SMYD3GAATDP1KDM4E | |
| SCHEMBL6992740 | 0.90 | SMYD3 (0.44) | HSD11B1SMYD3GAAABL1RIN1 | |
| Hydrochloric Acid SCHEMBL2925780 | 0.89 | KDM4E (0.43) | HSD11B1SMYD3GAATDP1KDM4E | |
| Hydrochloric Acid SCHEMBL7581129 | 0.88 | SMYD3 (0.43) | HSD11B1SMYD3GAAABL1RIN1 | |
| Hydrochloric Acid SCHEMBL21069720 | 0.88 | SMYD3 (0.43) | HSD11B1SMYD3GAAABL1RIN1 | |
| SCHEMBL22008496 | 0.86 | HSD11B1 (0.47) | HSD11B1SMYD3GAAABL1RIN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7820699-B2 | Cyclic amines | HOFFMANN-LA ROCHE INC. (US) | 2010-10-26 | — | — | US | disclosed |