Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | ACR | P10323 | 1/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.47 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MGLL | Q99685 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29038955 | 0.87 | ALDH1A1 (0.58) | ALDH1A1CYP1A2CYP2D6HIF1AMAPT | |
| SCHEMBL9305421 | 0.87 | HSD17B10 (0.52) | ALDH1A1CYP1A2MAPTPRSS1ACR | |
| SCHEMBL8496209 | 0.87 | ALDH1A1 (0.58) | ALDH1A1CYP1A2CYP2D6HIF1AMAPT | |
| SCHEMBL12362581 | 0.83 | CYP1A2 (0.58) | ALDH1A1CYP1A2CYP2D6HIF1AMAPT | |
| SCHEMBL8074450 | 0.83 | CYP1A2 (0.58) | ALDH1A1CYP1A2CYP2D6HIF1AMAPT | |
| SCHEMBL11709820 | 0.83 | PRSS1 (0.62) | ALDH1A1CYP1A2CYP2D6HIF1AMAPT | |
| SCHEMBL6864700 | 0.83 | PRSS1 (0.62) | ALDH1A1CYP1A2CYP2D6HIF1AMAPT | |
| SCHEMBL11125066 | 0.83 | MAPT (0.55) | ALDH1A1CYP1A2CYP2D6HIF1AMAPT | |
| SCHEMBL8074037 | 0.83 | CYP1A2 (0.58) | ALDH1A1CYP1A2CYP2D6HIF1AMAPT | |
| SCHEMBL9306527 | 0.82 | HSD17B10 (0.51) | ALDH1A1CYP1A2MAPTPRSS1ACR |
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-5277838-A | Silylated benzoic acid derivatives | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 1994-01-11 | — | — | US | disclosed |