Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | ACACB | O00763 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.39 |
| ▸ | NPC1 | O15118 | 6/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 5/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.39 |
| ▸ | RELA | Q04206 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9496522 | 0.96 | RAB9A (0.46) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL9495966 | 0.95 | RAB9A (0.45) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL9497180 | 0.95 | RAB9A (0.45) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL9499663 | 0.94 | RAB9A (0.41) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL9496215 | 0.93 | RAB9A (0.38) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL9496652 | 0.93 | RAB9A (0.40) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL9496664 | 0.93 | ACACB (0.41) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL9495259 | 0.92 | CASP3 (0.41) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL10512719 | 0.91 | MAPT (0.41) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 | |
| SCHEMBL9496009 | 0.91 | RAB9A (0.43) | RAB9AMAPTL3MBTL1ACACBSMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0306505-B1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES | MERCK PATENT GmbH (DE) | 1993-03-24 | — | — | EP | disclosed |
| US-5068053-A | Liquid crystals for optical apparatus | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |