Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VKORC1 | Q9BQB6 | 3/20 | 0.82 |
| ▸ | NQO1 | P15559 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 5/20 | 0.37 |
| ▸ | MAOA | P21397 | 4/20 | 0.37 |
| ▸ | AR | P10275 | 2/20 | 0.37 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10694018 | 1.00 | VKORC1 (0.82) | VKORC1NQO1THRBMAOBMAOA | |
| SCHEMBL10693000 | 0.94 | VKORC1 (0.71) | VKORC1NQO1MAOBMAOAKDM4E | |
| SCHEMBL10688883 | 0.94 | VKORC1 (0.71) | VKORC1NQO1MAOBMAOAKDM4E | |
| SCHEMBL10691535 | 0.91 | VKORC1 (0.67) | VKORC1NQO1MAOBMAOAKDM4E | |
| SCHEMBL10688149 | 0.91 | VKORC1 (0.89) | VKORC1NQO1THRBALDH1A1 | |
| Brodifacoum SCHEMBL435133 | 0.91 | VKORC1 (1.00) | VKORC1NQO1THRBKDM4EALDH1A1 | |
| Brodifacoum SCHEMBL29455095 | 0.91 | VKORC1 (1.00) | VKORC1NQO1THRBKDM4EALDH1A1 | |
| SCHEMBL10691142 | 0.90 | VKORC1 (0.65) | VKORC1NQO1MAOBMAOAAR | |
| SCHEMBL10866030 | 0.88 | VKORC1 (0.62) | VKORC1NQO1MAOBMAOAAR | |
| SCHEMBL20530990 | 0.88 | VKORC1 (0.62) | VKORC1NQO1MAOBMAOAAR |
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-4748185-A | RODENTICIDES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1988-05-31 | — | — | US | disclosed |