Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | SHBG | P04278 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MPO | P05164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL841075 | 0.87 | ALDH1A1 (0.50) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL7555907 | 0.80 | POLB (0.43) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL307367 | 0.79 | ALDH1A1 (0.55) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL12607301 | 0.78 | ALDH1A1 (0.48) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| Ammonia Solution, Strong SCHEMBL3031871 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL8371085 | 0.75 | ALDH1A1 (0.41) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL10799481 | 0.72 | CYP3A4 (0.45) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL3946139 | 0.71 | ALDH1A1 (0.43) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL4361837 | 0.71 | AMY1A (0.55) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL13126285 | 0.71 | AMY1A (0.55) | ALDH1A1TP53CYP3A4TSHRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3212614-B1 | PROCESS FOR MAKING BENZOXAZINES | CYTEC IND INC (US) | 2019-05-01 | — | — | EP | disclosed |