Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 13/20 | 0.63 |
| ▸ | NPC1 | O15118 | 8/20 | 0.63 |
| ▸ | RAB9A | P51151 | 8/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.63 |
| ▸ | MAPT | P10636 | 6/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.61 |
| ▸ | RELA | Q04206 | 3/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | PKM | P14618 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29740249 | 0.87 | TP53 (0.69) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL12970198 | 0.83 | NPC1 (0.66) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL30059210 | 0.83 | NPC1 (0.66) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL2496897 | 0.82 | TP53 (0.68) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL11822108 | 0.81 | TP53 (0.59) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL12970535 | 0.80 | SMN1; SMN2 (0.59) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL969616 | 0.80 | NPC1 (0.66) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL4147815 | 0.80 | NPC1 (0.66) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL1728599 | 0.80 | SMN1; SMN2 (0.66) | TP53NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL5773733 | 0.80 | TP53 (0.68) | TP53NPC1RAB9ASMN1; SMN2MAPT |
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-2003028728-A1 | 4-(4-SUBSTITUTED PIPERAZINYL-1YL)-BUTYLCARBOXAMIDES AS D3 DOPAMINE SUBTYPE SELECTIVE LIGANDS | Richter Gedeon Vegyészeti Gyár Rt. (HU) | 2003-04-10 | — | — | WO | disclosed |