Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL310005 | 0.82 | NPSR1 (0.64) | ALDH1A1NPSR1HTTL3MBTL1TSHR | |
| SCHEMBL4871807 | 0.81 | ESR1 (0.64) | ALDH1A1LMNATP53ESR1ESR2 | |
| SCHEMBL9547516 | 0.79 | NPSR1 (0.54) | ALDH1A1LMNATP53ESR1ESR2 | |
| SCHEMBL16291799 | 0.78 | ESR1 (0.65) | ALDH1A1LMNATP53ESR1ESR2 | |
| SCHEMBL4903337 | 0.78 | ALDH1A1 (0.48) | ALDH1A1LMNATP53ESR1ESR2 | |
| SCHEMBL1118865 | 0.77 | PTGIR (0.47) | ALDH1A1ESR1ESR2NPSR1HTT | |
| SCHEMBL1118695 | 0.77 | NPSR1 (0.52) | ALDH1A1LMNANPSR1HTTL3MBTL1 | |
| SCHEMBL1118562 | 0.76 | PTGIR (0.47) | ALDH1A1LMNATP53NPSR1HTT | |
| SCHEMBL9547587 | 0.76 | ESR1 (0.49) | ALDH1A1LMNATP53ESR1ESR2 | |
| SCHEMBL1176872 | 0.76 | ESR1 (0.49) | ALDH1A1LMNATP53ESR1ESR2 |
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-0929217-B1 | SORDARIN DERIVATIVES | MERCK & CO INC (US) | 2004-03-03 | — | — | EP | disclosed |