Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HTRA1 | Q92743 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7449608 | 0.91 | NR1H4 (0.56) | NR1H4MAPTNPSR1L3MBTL1HDAC1 | |
| SCHEMBL7446916 | 0.86 | HDAC1 (0.50) | MAPTNPSR1L3MBTL1HDAC1RECQL | |
| SCHEMBL21523879 | 0.82 | NPC1 (0.64) | NR1H4MAPTNPSR1L3MBTL1HDAC1 | |
| SCHEMBL7451771 | 0.81 | MAPT (0.47) | MAPTNPSR1L3MBTL1RECQLNAMPT | |
| SCHEMBL7452422 | 0.80 | CYP1A2 (0.45) | NR1H4MAPTL3MBTL1HDAC1NAMPT | |
| SCHEMBL23775465 | 0.79 | ALDH1A1 (0.58) | NR1H4MAPTNPSR1L3MBTL1HDAC1 | |
| SCHEMBL6395877 | 0.78 | NAMPT (0.50) | NR1H4MAPTNPSR1L3MBTL1HDAC1 | |
| SCHEMBL7448308 | 0.78 | HDAC1 (0.52) | L3MBTL1HDAC1NAMPTMEN1KMT2A | |
| SCHEMBL4815641 | 0.76 | NAMPT (0.51) | NR1H4MAPTNPSR1L3MBTL1HDAC1 | |
| SCHEMBL7446767 | 0.76 | HDAC1 (0.48) | MAPTL3MBTL1HDAC1NAMPTALDH1A1 |
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-2001027096-A9 | AMINOMETHYL-(HETERO)ARYL DERIVATIVES AND THEIR USE AS TRYPTASE INHIBITORS | PROTHERICS MOLECULAR DESIGN LT (GB) | 2001-07-12 | — | — | WO | disclosed |