Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.55 |
| ▸ | CA1 | P00915 | 5/20 | 0.55 |
| ▸ | CA2 | P00918 | 5/20 | 0.55 |
| ▸ | CA9 | Q16790 | 5/20 | 0.55 |
| ▸ | IDO1 | P14902 | 1/20 | 0.54 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.53 |
| ▸ | JAK2 | O60674 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 3/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.48 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7336799 | 0.96 | CA12 (0.56) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL2830568 | 0.86 | MTNR1A (0.67) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL15869790 | 0.86 | ALDH1A1 (0.55) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL28868419 | 0.86 | SCN9A (0.53) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL25470611 | 0.84 | CA12 (0.54) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL17515810 | 0.84 | KDM4E (0.63) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL30032343 | 0.84 | SCN9A (0.52) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL14804193 | 0.84 | MEN1 (0.67) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL7425171 | 0.84 | RAB9A (0.63) | CA12CA1CA2CA9IDO1 | |
| SCHEMBL10567738 | 0.84 | SCN9A (0.52) | CA12CA1CA2CA9IDO1 |
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-4818766-A | ANTIARRHYTHMIA AGENTS, HYPOTENSIVE AGENTS, TREATMENT OF ANGINA | CIBA-GEIGY CORPORATION (US) | 1989-04-04 | — | — | US | disclosed |