Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | GPX4 | P36969 | 1/20 | 0.44 |
| ▸ | GABRP | O00591 | 1/20 | 0.43 |
| ▸ | GABRD | O14764 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.43 |
| ▸ | GABRE | P78334 | 1/20 | 0.43 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15271897 | 0.78 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 | |
| SCHEMBL15269042 | 0.78 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 | |
| SCHEMBL8393232 | 0.78 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 | |
| SCHEMBL15269110 | 0.78 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 | |
| SCHEMBL8393246 | 0.76 | NPC1 (0.64) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 | |
| SCHEMBL25306059 | 0.75 | ALDH1A1 (0.49) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 | |
| SCHEMBL29001248 | 0.73 | NPC1 (0.52) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 | |
| SCHEMBL20323095 | 0.73 | GABRP (0.47) | NPC1RAB9ASMN1; SMN2ALDH1A1GABRP | |
| SCHEMBL10912458 | 0.72 | HSD17B10 (0.44) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 | |
| SCHEMBL6780126 | 0.72 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2ALDH1A1PAX8 |
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-0027952-A1 | Process for preparing N,O-disubstituted urethanes | BAYER AG (DE) | 1981-05-06 | — | — | EP | disclosed |