Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.60 |
| ▸ | CES1 | P23141 | 2/20 | 0.60 |
| ▸ | CA1 | P00915 | 2/20 | 0.60 |
| ▸ | CA2 | P00918 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1901209 | 0.85 | CA1 (0.62) | CES2CES1CA1CA2ALDH1A1 | |
| SCHEMBL233887 | 0.83 | CES2 (0.86) | CES2CES1CA1CA2ALDH1A1 | |
| P-Nitrophenylphosphate SCHEMBL2771528 | 0.83 | CA1 (0.86) | CES2CES1CA1CA2ALDH1A1 | |
| SCHEMBL5933832 | 0.82 | ALDH1A1 (0.61) | CES2CES1CA1CA2ALDH1A1 | |
| SCHEMBL955844 | 0.81 | CA1 (0.70) | CES2CES1CA1CA2ALDH1A1 | |
| SCHEMBL28160072 | 0.81 | MAPK1 (0.57) | CES2CES1CA1CA2ALDH1A1 | |
| SCHEMBL28961677 | 0.81 | ALDH1A1 (0.43) | CES2CES1CA1CA2ALDH1A1 | |
| SCHEMBL959287 | 0.80 | CA1 (0.63) | CES2CES1CA1CA2ALDH1A1 | |
| SCHEMBL10410659 | 0.80 | CA1 (0.63) | CES2CES1CA1CA2ALDH1A1 | |
| SCHEMBL7294901 | 0.79 | ALDH1A1 (0.57) | CES2CES1CA1CA2ALDH1A1 |
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-4035488-A | Insecticidal and acaricidal substituted phenyl thiophosphoric acid esters | CIBA-GEIGY CORPORATION (US) | 1977-07-12 | — | — | US | disclosed |