Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200678 | 0.94 | NPC1 (0.30) | NPC1RAB9ASMN1; SMN2HTTNCOA1 | |
| SCHEMBL14200757 | 0.94 | NFKB1 (0.35) | NFKB1L3MBTL1KDM4EMEN1ALDH1A1 | |
| SCHEMBL14200647 | 0.89 | HTT (0.31) | SMN1; SMN2HTTNCOA1NCOA3 | |
| SCHEMBL14229720 | 0.89 | NFKB1 (0.41) | NFKB1L3MBTL1KDM4EMEN1ALDH1A1 | |
| SCHEMBL19891748 | 0.88 | AOC3 (0.33) | MAPTSMN1; SMN2HTTNCOA1NCOA3 | |
| SCHEMBL14229386 | 0.85 | NFKB1 (0.39) | NFKB1L3MBTL1KDM4EMEN1ALDH1A1 | |
| SCHEMBL14200754 | 0.84 | MAPT (0.34) | KDM4EMAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14230156 | 0.82 | SMN1; SMN2 (0.35) | NFKB1L3MBTL1KDM4EMEN1ALDH1A1 | |
| SCHEMBL14200756 | 0.80 | MAPT (0.33) | MAPTSMN1; SMN2 | |
| SCHEMBL14229191 | 0.79 | SMN1; SMN2 (0.37) | NFKB1L3MBTL1KDM4EMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |