Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.40 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.37 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 1/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11667729 | 0.80 | PDE7A (0.51) | ALDH1A1HPGDTSHRPDE7APDE7B | |
| SCHEMBL10938097 | 0.79 | CYP2C19 (0.47) | ALDH1A1HPGDTSHRPDE7APDE7B | |
| SCHEMBL181041 | 0.78 | ALDH1A1 (1.00) | ALDH1A1HPGDTSHRTDP1POLB | |
| SCHEMBL10952768 | 0.75 | ALDH1A1 (0.69) | ALDH1A1HPGDTSHRPDE7APDE7B | |
| SCHEMBL7291481 | 0.74 | ALDH1A1 (0.72) | ALDH1A1HPGDTSHRTDP1POLB | |
| SCHEMBL28410272 | 0.74 | ALDH1A1 (0.81) | ALDH1A1HPGDTSHRTDP1POLB | |
| SCHEMBL10867768 | 0.73 | ALDH1A1 (0.70) | ALDH1A1HPGDTSHRTDP1POLB | |
| SCHEMBL7734149 | 0.73 | ALDH1A1 (0.70) | ALDH1A1HPGDTSHRTDP1POLB | |
| SCHEMBL10959778 | 0.73 | ALDH1A1 (0.70) | ALDH1A1HPGDTSHRTDP1POLB | |
| SCHEMBL6130889 | 0.73 | ALDH1A1 (0.70) | ALDH1A1HPGDTSHRTDP1POLB |
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-4502998-A | Nucleophilic substitution process | ETHYL CORPORATION (US) | 1985-03-05 | — | — | US | claimed |
| US-4502998-A | Nucleophilic substitution process | ETHYL CORPORATION (US) | 1985-03-05 | — | — | US | disclosed |