Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 6/20 | 0.39 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | HTR7 | P34969 | 2/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13565621 | 1.00 | THRB (0.42) | THRBFAAHCNR2CNR1HTR1A | |
| SCHEMBL13565482 | 0.91 | HDAC4 (0.41) | ALDH1A1KDM4ELMNAHTTTDP1 | |
| SCHEMBL17090309 | 0.91 | HDAC4 (0.41) | ALDH1A1KDM4ELMNAHTTTDP1 | |
| SCHEMBL13565132 | 0.89 | NR1H4 (0.40) | NR1H4F10MEN1NPC1MAPT | |
| SCHEMBL17090000 | 0.89 | NR1H4 (0.40) | NR1H4F10MEN1NPC1MAPT | |
| SCHEMBL17089960 | 0.88 | NPC1 (0.42) | CNR2ALDH1A1KDM4ELMNAHTT | |
| SCHEMBL13565623 | 0.88 | NPC1 (0.42) | CNR2ALDH1A1KDM4ELMNAHTT | |
| SCHEMBL17090308 | 0.87 | F10 (0.37) | CNR2CNR1HTR1AHTR7ALDH1A1 | |
| SCHEMBL13565615 | 0.87 | F10 (0.37) | CNR2CNR1HTR1AHTR7ALDH1A1 | |
| SCHEMBL13564820 | 0.86 | THRB (0.42) | THRBFAAHCNR2CNR1HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |