Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | ERN1 | O75460 | 1/20 | 0.44 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | STAT1 | P42224 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.41 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.41 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL3019577 | 0.84 | ALDH1A1 (0.42) | ALDH1A1HIF1AERN1GLO1TDP1 | |
| SCHEMBL3019574 | 0.84 | ALDH1A1 (0.42) | ALDH1A1HIF1AERN1GLO1TDP1 | |
| SCHEMBL3019575 | 0.84 | ALDH1A1 (0.42) | ALDH1A1HIF1AERN1GLO1TDP1 | |
| Acetic Acid SCHEMBL1591940 | 0.81 | ERN1 (0.53) | ALDH1A1HIF1AERN1TDP1MAPT | |
| SCHEMBL16307975 | 0.80 | ERN1 (0.60) | ALDH1A1ERN1GLO1TDP1TSHR | |
| SCHEMBL1591294 | 0.79 | ERN1 (0.58) | ALDH1A1HIF1AERN1TDP1TSHR | |
| SCHEMBL14198017 | 0.78 | ERN1 (0.67) | ALDH1A1ERN1TDP1TSHRMAPT | |
| SCHEMBL16652403 | 0.78 | SMN1; SMN2 (0.51) | ALDH1A1ERN1GLO1TDP1TSHR | |
| SCHEMBL5923822 | 0.77 | ALDH1A1 (0.52) | ALDH1A1HIF1AERN1TDP1TSHR | |
| SCHEMBL376864 | 0.77 | ALDH1A1 (0.52) | ALDH1A1HIF1AERN1TDP1TSHR |
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-5789417-A | ANTICARCINOGENIC AGENTS | ZENECA LIMITED (GB) | 1998-08-04 | — | — | US | disclosed |
| US-5747499-A | CYCLOPENTAQUINAZOLINE COMPOUNDS CYCLOPENTAQUINAZOLINE COMPOUNDS | BRITISH TECHNOLOGY GROUP LIMITED (GB) | 1998-05-05 | — | — | US | disclosed |