Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24495630 | 0.81 | NPSR1 (0.38) | NPSR1KMT2AHDAC1HDAC6ALDH1A1 | |
| SCHEMBL22145797 | 0.75 | TRPA1 (0.40) | KMT2AHDAC1HDAC6MAPTRAB9A | |
| SCHEMBL13594207 | 0.73 | NPSR1 (0.37) | NPSR1KMT2AHDAC1HDAC6ALDH1A1 | |
| SCHEMBL20825131 | 0.71 | NPSR1 (0.40) | NPSR1KMT2AHDAC1HDAC6ALDH1A1 | |
| SCHEMBL13465562 | 0.69 | NPSR1 (0.40) | NPSR1KMT2AHDAC1HDAC6ALDH1A1 | |
| SCHEMBL13083477 | 0.66 | — | — | |
| SCHEMBL12045440 | 0.64 | MTNR1A (0.38) | NPSR1KMT2AHDAC1HDAC6ALDH1A1 | |
| SCHEMBL24312000 | 0.64 | ALDH1A1 (0.34) | KMT2AALDH1A1MAPTRAB9ATSHR | |
| SCHEMBL13089099 | 0.63 | AURKA (0.41) | NPSR1KMT2AHDAC1HDAC6ALDH1A1 | |
| SCHEMBL2530016 | 0.63 | KMT2A (0.63) | KMT2AHDAC1HDAC6ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2189449-A1 | AMINOPYRAZOLE AMIDE DERIVATIVE | Dainippon Sumitomo Pharma Co., Ltd. (JP) | 2010-05-26 | — | — | EP | disclosed |