Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5503046 | 0.86 | — | — | |
| SCHEMBL3645869 | 0.82 | — | — | |
| SCHEMBL17423456 | 0.80 | PIK3CD (0.33) | PIK3CDHTTKMT2ASMN1; SMN2TDP1 | |
| SCHEMBL1026427 | 0.77 | — | — | |
| SCHEMBL5317263 | 0.77 | — | — | |
| SCHEMBL74560 | 0.76 | TP53 (0.47) | SMN1; SMN2 | |
| SCHEMBL74559 | 0.76 | PIK3CD (0.32) | PIK3CDHTTKMT2ASMN1; SMN2TDP1 | |
| SCHEMBL10318403 | 0.76 | PIK3CD (0.32) | PIK3CDHDAC1HDAC2HTTKMT2A | |
| SCHEMBL18795947 | 0.76 | MAPT (0.36) | PIK3CDSMN1; SMN2 | |
| SCHEMBL1584170 | 0.75 | CES2 (0.50) | HTTKMT2ASMN1; SMN2TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3240792-A1 | HETEROCYCLYLALKYNE DERIVATIVES AND THEIR USE AS MODULATORS OF MGLUR5 RECEPTORS | Recordati Ireland Limited (IE) | 2017-11-08 | — | — | EP | disclosed |
| WO-2016107865-A1 | HETEROCYCLYLALKYNE DERIVATIVES AND THEIR USE AS MODULATORS OF MGLUR5 RECEPTORS | RECORDATI IRELAND LIMITED (IE) | 2016-07-07 | — | — | WO | disclosed |