Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | NOS3 | P29474 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | NOS2 | P35228 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL8223673 | 0.84 | CA1 (0.43) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL11041537 | 0.84 | CA1 (0.43) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL13366801 | 0.84 | CA1 (0.43) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL15041052 | 0.84 | CA1 (0.43) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL15041053 | 0.84 | CA1 (0.43) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL12890253 | 0.84 | CA1 (0.43) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL11922731 | 0.84 | CA1 (0.43) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL10596596 | 0.83 | CA1 (0.41) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL28713977 | 0.80 | CA1 (0.41) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL17862091 | 0.78 | SMN1; SMN2 (0.44) | SMN1; SMN2CA1CA2CA14ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5830875-A | PARASITICIDES | MERCK & CO., INC. (US) | 1998-11-03 | — | — | US | disclosed |
| EP-0428286-A2 | 24- and 25-substituted avermectin and milbemycin derivatives | MERCK & CO. INC. (US) | 1991-05-22 | — | — | EP | disclosed |