Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | PLK4 | O00444 | 1/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.47 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.47 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.47 |
| ▸ | CDK1 | P06493 | 1/20 | 0.47 |
| ▸ | RET | P07949 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.47 |
| ▸ | FLT1 | P17948 | 1/20 | 0.47 |
| ▸ | MARK3 | P27448 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | AXL | P30530 | 1/20 | 0.47 |
| ▸ | FLT4 | P35916 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6175361 | 0.75 | NPC1 (0.61) | NPC1RAB9AMEN1KMT2APOLB | |
| SCHEMBL13162648 | 0.74 | NPC1 (0.59) | NPC1RAB9AKMT2APOLBHTR7 | |
| SCHEMBL6613583 | 0.74 | PLK1 (0.61) | NPC1HTR2AHTR2CSLC6A4POLB | |
| SCHEMBL8167653 | 0.72 | HDAC6 (0.69) | MEN1KMT2APOLBEPHX1 | |
| SCHEMBL15444821 | 0.72 | BRD4 (0.63) | NPC1BRD4RAB9AMEN1KMT2A | |
| Methyl Alcohol SCHEMBL11518093 | 0.72 | SMN1; SMN2 (0.72) | MEN1KMT2APOLBEPHX1 | |
| SCHEMBL1927570 | 0.72 | MEN1 (0.83) | NPC1MEN1KMT2APOLBEPHX1 | |
| SCHEMBL25123079 | 0.72 | SMN1; SMN2 (0.76) | NPC1RAB9AMEN1KMT2APOLB | |
| SCHEMBL4522241 | 0.72 | SMN1; SMN2 (0.76) | NPC1RAB9AMEN1KMT2APOLB | |
| SCHEMBL8395225 | 0.72 | SMN1; SMN2 (0.76) | NPC1RAB9AMEN1KMT2APOLB |
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-2010038948-A2 | ARYLPIPERAZINE-CONTAINING PYRROLE 3-CARBOXAMIDE DERIVATIVES FOR TREATING DEPRESSIVE DISORDERS | GREEN CROSS CORPORATION (KR) | 2010-04-08 | — | — | WO | disclosed |