Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL1554275 | 0.94 | PKM (0.55) | PKMDHFR | |
| SCHEMBL29352921 | 0.94 | PKM (0.55) | PKMDHFR | |
| SCHEMBL30872658 | 0.93 | PKM (0.54) | PKMDHFR | |
| SCHEMBL16701417 | 0.93 | PKM (0.54) | PKMDHFR | |
| SCHEMBL16701413 | 0.93 | PKM (0.54) | PKMDHFR | |
| SCHEMBL9499492 | 0.93 | PKM (0.54) | PKMDHFR | |
| Benzene SCHEMBL27894272 | 0.91 | PKM (0.52) | PKMDHFR | |
| SCHEMBL2450159 | 0.88 | DHFR (0.59) | PKMDHFR | |
| SCHEMBL30715140 | 0.88 | DHFR (0.59) | PKMDHFR | |
| Hydrochloric Acid SCHEMBL28530443 | 0.86 | DHFR (0.57) | PKMDHFR |
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-107739371-A | A kind of Tetrahydrocarbazolesand small molecular organic compounds and its purposes in antibacterials are prepared and preparation method thereof | 华东师范大学 | 2018-02-27 | — | — | CN | disclosed |