Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 13/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA4 | P22748 | 2/20 | 0.37 |
| ▸ | CA6 | P23280 | 2/20 | 0.37 |
| ▸ | CA5A | P35218 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL5602626 | 0.85 | NOTUM (0.47) | NOTUMKEAP1CYP2C9CYP19A1LMNA | |
| SCHEMBL7404546 | 0.79 | NOTUM (0.58) | NOTUMKEAP1CYP19A1 | |
| SCHEMBL20522525 | 0.78 | CYP19A1 (0.43) | NOTUMKEAP1CA12CA1CA2 | |
| SCHEMBL18118202 | 0.76 | NOTUM (0.55) | NOTUMCA12CA1CA2CA5A | |
| SCHEMBL27818248 | 0.75 | NOTUM (0.50) | NOTUMKEAP1CYP19A1 | |
| SCHEMBL22325390 | 0.74 | NOTUM (0.53) | NOTUMKEAP1CYP19A1GAA | |
| SCHEMBL29764447 | 0.74 | LMNA (0.64) | NOTUMKEAP1CA12CA1CA2 | |
| SCHEMBL7090693 | 0.73 | NOTUM (0.47) | NOTUMKEAP1CYP19A1GAAMAPK10 | |
| SCHEMBL5138812 | 0.73 | CA1 (0.44) | NOTUMKEAP1CA12CA1CA2 | |
| SCHEMBL2359098 | 0.72 | NOTUM (0.54) | NOTUMKEAP1CYP2C9CYP19A1 |
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-2016146833-A1 | BIOMARKERS FOR NAD(+)-DIPHTHAMIDE ADP RIBOSYLTRANSFERASE RESISTANCE | F. HOFFMANN-LA ROCHE AG (CH) | 2016-09-22 | — | — | WO | disclosed |