Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NCEH1 | Q6PIU2 | 3/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | CFD | P00746 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | SNCA | P37840 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.30 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.30 |
| ▸ | TOP1 | P11387 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | PIM1 | P11309 | 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 | |
|---|---|---|---|---|
| SCHEMBL27588996 | 0.73 | ACHE (0.38) | TSHRACHEKDM4EALDH1A1GAA | |
| SCHEMBL992563 | 0.71 | TSPO (0.44) | TSHRSMN1; SMN2ACHEKDM4EALDH1A1 | |
| SCHEMBL27427104 | 0.69 | AAK1 (0.36) | SMN1; SMN2NCEH1KDM4EALDH1A1GAA | |
| SCHEMBL5736205 | 0.68 | ACHE (0.40) | TSHRSMN1; SMN2ACHEKDM4EALDH1A1 | |
| SCHEMBL992564 | 0.68 | RAB9A (0.50) | SMN1; SMN2ALDH1A1RAB9APAX8ELANE | |
| SCHEMBL24195886 | 0.67 | KDM4E (0.47) | TSHRACHEKDM4EALDH1A1GAA | |
| SCHEMBL29837226 | 0.66 | PAX8 (0.41) | TSHRSMN1; SMN2ALDH1A1GAARAB9A | |
| SCHEMBL27630345 | 0.66 | BRD4 (0.42) | TSHRSMN1; SMN2KDM4EALDH1A1RAB9A | |
| SCHEMBL22134679 | 0.66 | ALDH1A1 (0.35) | NCEH1KDM4EALDH1A1GAAPAX8 | |
| SCHEMBL28943941 | 0.66 | ACHE (0.37) | TSHRACHEKDM4EALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011011483-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2011-01-27 | — | — | WO | disclosed |