Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 9/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL9511384 | 0.84 | ACACB (0.41) | ACACBKCNH2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL10522689 | 0.83 | APP (0.46) | MEN1KMT2AACACBMCHR1NPC1 | |
| SCHEMBL9510047 | 0.83 | MCHR1 (0.51) | MEN1KMT2AACACBMCHR1NPC1 | |
| SCHEMBL9512492 | 0.83 | ACACB (0.47) | ACACBCHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL9508839 | 0.81 | ACACB (0.52) | MEN1KMT2AACACBSMN1; SMN2ALDH1A1 | |
| SCHEMBL9512258 | 0.79 | NPC1 (0.57) | MCHR1NPC1RAB9ASMN1; SMN2HSD17B10 | |
| SCHEMBL9508928 | 0.79 | ACACB (0.50) | MEN1KMT2AACACBSMN1; SMN2ALDH1A1 | |
| SCHEMBL9509250 | 0.78 | ALDH1A1 (0.54) | MEN1KMT2AACACBRAB9ASMN1; SMN2 | |
| SCHEMBL257325 | 0.77 | MEN1 (0.58) | MEN1KMT2AKCNH2NPC1RAB9A | |
| SCHEMBL3434851 | 0.77 | ACACB (0.57) | MEN1KMT2AACACBCHRNB2CHRNB4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |