Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.45 |
| ▸ | FLT3 | P36888 | 9/20 | 0.44 |
| ▸ | KDR | P35968 | 3/20 | 0.44 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.44 |
| ▸ | AURKA | O14965 | 2/20 | 0.44 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.42 |
| ▸ | RET | P07949 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12955112 | 0.88 | NPC1 (0.49) | RAB9ANPC1MAPK14FLT3KDR | |
| SCHEMBL13663328 | 0.85 | ALDH1A1 (0.50) | KMT2AHTTMEN1 | |
| Trifluoroacetic Acid SCHEMBL1021698 | 0.85 | NPC1 (0.46) | RAB9ANPC1MAPK14FLT3KDR | |
| SCHEMBL13896427 | 0.83 | MEN1 (0.40) | KMT2AHTTMEN1 | |
| SCHEMBL13663395 | 0.83 | MEN1 (0.41) | KMT2AMEN1 | |
| SCHEMBL1021700 | 0.82 | RAB9A (0.46) | RAB9ANPC1MAPK14FLT3KDR | |
| SCHEMBL13896425 | 0.81 | MEN1 (0.40) | KMT2AMAPTMEN1 | |
| SCHEMBL13663456 | 0.81 | ALDH1A1 (0.49) | KMT2AHTTMEN1 | |
| SCHEMBL13663455 | 0.81 | MEN1 (0.41) | KMT2AMEN1 | |
| SCHEMBL1512416 | 0.81 | FLT3 (0.52) | RAB9ANPC1MAPK14FLT3KDR |
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-8314091-B2 | N-benzyl,N'-arylcarbonylpiperazine derivatives | MSD OSS B.V. (NL) | 2012-11-20 | — | — | US | disclosed |