Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B7 | P16662 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 16/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 16/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 16/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 13/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 10/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11523341 | 0.82 | MTOR (0.41) | CYP2D6CYP3A4CA1MEN1TSHR | |
| SCHEMBL11525863 | 0.77 | LMNA (0.50) | CYP3A4MEN1KMT2AHIF1A | |
| SCHEMBL11524159 | 0.77 | CNR1 (0.47) | SLC6A2SLC6A4SLC6A3MEN1KMT2A | |
| SCHEMBL11524088 | 0.75 | CYP1A2 (0.47) | CYP2D6CYP3A4MEN1CYP1A2TSHR | |
| SCHEMBL11525667 | 0.73 | ALDH1A1 (0.42) | MEN1TSHRKMT2A | |
| SCHEMBL19773809 | 0.73 | VDR (0.56) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL16179564 | 0.72 | UGT2B7 (0.57) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL18907258 | 0.71 | CYP3A4 (0.48) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL11526405 | 0.71 | CFTR (0.54) | SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4 | |
| SCHEMBL11527224 | 0.71 | POLB (0.55) | MEN1KMT2A |
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-4147780-A | α-Amino-phosphonous acids for inhibiting bacteria and yeast | CIBA-GEIGY CORPORATION (US) | 1979-04-03 | — | — | US | disclosed |