Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADCY10 | Q96PN6 | 5/20 | 0.32 |
| ▸ | NMT1 | P30419 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18603240 | 0.78 | ADCY10 (0.35) | ADCY10NMT1 | |
| SCHEMBL21171659 | 0.77 | ADCY10 (0.36) | ADCY10NMT1 | |
| SCHEMBL21171808 | 0.76 | NMT1 (0.35) | ADCY10NMT1 | |
| SCHEMBL18622401 | 0.68 | ALDH1A1 (0.34) | NMT1 | |
| SCHEMBL13106183 | 0.65 | HSD11B1 (0.37) | ADCY10NMT1 | |
| SCHEMBL14769545 | 0.61 | S1PR2 (0.34) | — | |
| SCHEMBL13106181 | 0.60 | CHRM4 (0.35) | NMT1 | |
| SCHEMBL14035378 | 0.59 | CYP1A2 (0.35) | — | |
| SCHEMBL23251311 | 0.59 | NPC1 (0.30) | — | |
| SCHEMBL15595934 | 0.59 | NOS3 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017042100-A1 | PYRAZOLYL-SUBSTITUTED HETEROARYLS AND THEIR USE AS MEDICAMENTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2017-03-16 | — | — | WO | disclosed |