Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28778770 | 0.86 | KDM4E (0.55) | PKMKDM4EGAARECQLKMT2A | |
| SCHEMBL7038420 | 0.86 | POLB (0.54) | CYP1A2CYP2D6SMN1; SMN2CYP3A4CYP2C9 | |
| SCHEMBL23027213 | 0.86 | POLB (0.54) | CYP1A2CYP2D6SMN1; SMN2CYP3A4CYP2C9 | |
| SCHEMBL28333199 | 0.84 | CYP1A2 (0.47) | CYP1A2CYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10597656 | 0.83 | CYP1A2 (0.46) | CYP1A2CYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2288515 | 0.83 | KMT2A (0.56) | CYP1A2CYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2294572 | 0.82 | ALDH1A1 (0.49) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL27904388 | 0.81 | CYP1A2 (0.45) | CYP1A2CYP2D6CYP3A4CYP2C9CYP2C19 | |
| Water SCHEMBL27364395 | 0.81 | KMT2A (0.55) | CYP1A2CYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2293067 | 0.81 | NPC1 (0.55) | SMN1; SMN2CYP3A4KDM4ECHRM1LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105237526-B | A kind of anti-hiv drug and preparation method thereof | 朱靖华 | 2018-01-23 | — | — | CN | disclosed |
| CN-105294589-B | A kind of antiviral drugs and preparation method thereof | 朱靖华 | 2017-06-30 | — | — | CN | disclosed |
| CN-105294589-A | Antiviral drug and preparation method therefor | ZHU JINGHUA | 2016-02-03 | — | — | CN | disclosed |
| CN-105237526-A | Anti-HIV drug and preparation method therefor | ZHU JINGHUA | 2016-01-13 | — | — | CN | disclosed |