Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | KCNJ1 | P48048 | 3/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.49 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10695276 | 1.00 | TSHR (0.59) | TSHRALDH1A1KDM4EUSP2LMNA | |
| SCHEMBL6680919 | 0.85 | TSHR (0.58) | TSHRALDH1A1KDM4EUSP2LMNA | |
| SCHEMBL5661624 | 0.84 | TSHR (0.61) | TSHRALDH1A1KCNJ1KCNH2LOXL2 | |
| SCHEMBL5743507 | 0.83 | TSHR (0.56) | TSHRALDH1A1KDM4EUSP2LMNA | |
| SCHEMBL4754818 | 0.82 | TSHR (0.59) | TSHRALDH1A1KCNJ1KCNH2LOXL2 | |
| SCHEMBL8855359 | 0.82 | TSHR (0.55) | TSHRALDH1A1KDM4EUSP2LMNA | |
| SCHEMBL1625876 | 0.81 | MEN1 (0.56) | TSHRALDH1A1KDM4ELMNAKCNJ1 | |
| SCHEMBL1625595 | 0.81 | MEN1 (0.56) | TSHRALDH1A1KDM4ELMNAKCNJ1 | |
| SCHEMBL1625885 | 0.81 | MEN1 (0.56) | TSHRALDH1A1KDM4ELMNAKCNJ1 | |
| SCHEMBL27847930 | 0.81 | TSHR (0.54) | TSHRALDH1A1KDM4EUSP2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0271795-A2 | Octahydro-10-oxo-6H-pyridazo[1,2-a][1,2]diazepin derivatives, intermediates and process for their preparation, and medicament containing them | F. HOFFMANN-LA ROCHE AG (CH) | 1988-06-22 | — | — | EP | disclosed |