Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5721197 | 0.86 | CA12 (0.32) | CA12CA1CA2CA9 | |
| SCHEMBL5721152 | 0.84 | HEXA (0.40) | — | |
| SCHEMBL5721475 | 0.84 | CA12 (0.33) | CA12CA1CA2CA9 | |
| SCHEMBL5721154 | 0.83 | CA12 (0.35) | DHFRCA12CA1CA2CA9 | |
| SCHEMBL5721654 | 0.82 | DHFR (0.34) | DHFR | |
| SCHEMBL5721694 | 0.81 | PDCD1 (0.31) | — | |
| SCHEMBL5721508 | 0.78 | PDK2 (0.30) | — | |
| SCHEMBL5721596 | 0.77 | GCGR (0.32) | — | |
| SCHEMBL5721479 | 0.76 | — | — | |
| SCHEMBL5721262 | 0.76 | CA12 (0.32) | CA12CA1CA2CA9 |
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-1640377-A1 | Metallocenes and catalyst compositions derived therefrom | Exxonmobil Chemical Patents Inc. (US) | 2006-03-29 | — | — | EP | disclosed |