Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | HRH2 | P25021 | 2/20 | 0.48 |
| ▸ | HRH1 | P35367 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | THRA | P10827 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 2/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11058344 | 1.00 | NPC1 (0.52) | NPC1L3MBTL1HRH2HRH1ALDH1A1 | |
| SCHEMBL9238131 | 0.91 | TP53 (0.56) | HRH2HRH1THRATHRBTP53 | |
| SCHEMBL9238129 | 0.91 | TP53 (0.56) | HRH2HRH1THRATHRBTP53 | |
| SCHEMBL10788192 | 0.85 | DRD2 (0.43) | — | |
| SCHEMBL10791856 | 0.81 | THRA (0.48) | L3MBTL1THRATHRB | |
| SCHEMBL9235808 | 0.81 | HDAC3 (0.45) | ALDH1A1LMNA | |
| SCHEMBL9235810 | 0.81 | HDAC3 (0.45) | ALDH1A1LMNA | |
| SCHEMBL9588652 | 0.81 | LMNA (0.56) | NPC1HRH2HRH1THRBTP53 | |
| SCHEMBL9588641 | 0.81 | LMNA (0.56) | NPC1HRH2HRH1THRBTP53 | |
| SCHEMBL9592218 | 0.80 | LMNA (0.57) | NPC1THRATHRBTP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4439015-A | Disubstituted ethanes | HOFFMANN-LA ROCHE INC. (US) | 1984-03-27 | — | — | US | disclosed |