Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 2/20 | 0.41 |
| ▸ | GRM5 | P41594 | 2/20 | 0.39 |
| ▸ | CLPP | Q16740 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13092381 | 0.91 | TACR3 (0.44) | TACR3GRM5CLPPMGLLMEN1 | |
| SCHEMBL7912369 | 0.85 | TACR3 (0.40) | TACR3GRM5CLPPMGLLMEN1 | |
| SCHEMBL7909985 | 0.83 | TACR3 (0.39) | TACR3GRM5CLPPMGLLMEN1 | |
| SCHEMBL7910364 | 0.82 | HDAC4 (0.39) | TACR3GRM5CLPPMGLLMEN1 | |
| SCHEMBL7915785 | 0.82 | TACR3 (0.40) | TACR3GRM5CLPPMGLLMEN1 | |
| SCHEMBL378447 | 0.81 | MGLL (0.48) | TACR3GRM5CLPPMGLLMEN1 | |
| SCHEMBL13092395 | 0.79 | TACR3 (0.42) | TACR3GRM5CLPPMGLLMEN1 | |
| SCHEMBL13092365 | 0.79 | TACR3 (0.42) | TACR3GRM5CLPPMEN1KMT2A | |
| SCHEMBL13092392 | 0.78 | TACR3 (0.41) | TACR3GRM5CLPPMGLLMEN1 | |
| SCHEMBL13092384 | 0.78 | HDAC4 (0.42) | TACR3GRM5CLPPMGLLMEN1 |
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-2010106081-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-23 | — | — | WO | disclosed |