Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.32 |
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9143730 | 0.83 | ALDH1A1 (0.38) | ALDH1A1TP53TSHRSLC7A5MAPT | |
| SCHEMBL13542998 | 0.82 | TP53 (0.42) | ALDH1A1TP53TSHRSLC7A5MAPT | |
| SCHEMBL5514917 | 0.82 | TP53 (0.42) | ALDH1A1TP53TSHRSLC7A5MAPT | |
| SCHEMBL10486549 | 0.81 | TP53 (0.43) | ALDH1A1TP53TSHRSLC7A5MAPT | |
| SCHEMBL14670244 | 0.77 | ALDH1A1 (0.33) | ALDH1A1TP53TSHRSLC7A5MAPT | |
| SCHEMBL24068013 | 0.76 | TSHR (0.45) | ALDH1A1TP53TSHRMAPTPTGS1 | |
| SCHEMBL18583195 | 0.76 | ALDH1A1 (0.36) | ALDH1A1TP53TSHRSLC7A5MAPT | |
| SCHEMBL31296595 | 0.76 | ALDH1A1 (0.36) | ALDH1A1TP53TSHRSLC7A5CYP2C19 | |
| SCHEMBL1604917 | 0.76 | ALDH1A1 (0.39) | ALDH1A1TP53TSHRSLC7A5MAPT | |
| SCHEMBL19529526 | 0.75 | SLC7A5 (0.32) | ALDH1A1TP53TSHRSLC7A5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008032164-A2 | BENZIMIDAZOLONE DERIVATIVES | PFIZER PRODUCTS INC. (US) | 2008-03-20 | — | — | WO | disclosed |