Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 17/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 14/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.50 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.50 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.50 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.50 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.50 |
| ▸ | HTR7 | P34969 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3268419 | 0.90 | SLC6A4 (0.68) | SLC6A4SLC6A2MEN1KMT2ASLC6A3 | |
| SCHEMBL3246700 | 0.84 | SLC6A4 (0.63) | SLC6A4SLC6A2MEN1KMT2ASLC6A3 | |
| SCHEMBL2962625 | 0.80 | OPRM1 (0.65) | SLC6A4SLC6A2SLC6A3CYP2D6KCNH2 | |
| SCHEMBL1964502 | 0.77 | CYP1A2 (0.62) | SLC6A4SLC6A2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL30364119 | 0.77 | OPRM1 (0.61) | SLC6A4SLC6A2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL8916036 | 0.77 | CYP1A2 (0.62) | SLC6A4SLC6A2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL30363975 | 0.77 | OPRM1 (0.61) | SLC6A4SLC6A2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL10413788 | 0.77 | SLC6A4 (0.69) | SLC6A4SLC6A2MEN1KMT2ASLC6A3 | |
| SCHEMBL8922757 | 0.75 | CYP1A2 (0.66) | SLC6A4SLC6A2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL4334322 | 0.75 | CYP1A2 (0.66) | SLC6A4SLC6A2CYP2D6KCNH2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107385449-A | A kind of corrosion inhibiter preparation method and application for suppressing carbon steel sour corrosion | 中国石油大学(华东) | 2017-11-24 | — | — | CN | disclosed |