Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6841248 | 0.85 | AHR (0.45) | NPC1RAB9AMEN1TP53MAPT | |
| SCHEMBL9265689 | 0.75 | CYP1A2 (0.38) | PTGS2PTGS1KDM4E | |
| SCHEMBL10939277 | 0.75 | AHR (0.45) | NPC1RAB9AMAPTALDH1A1KMO | |
| SCHEMBL7006949 | 0.75 | ALOX5 (0.42) | NPC1RAB9ATP53TSHR | |
| SCHEMBL9649078 | 0.74 | TSHR (0.31) | TSHR | |
| SCHEMBL9649234 | 0.73 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL2168967 | 0.71 | PTGS2 (0.44) | NPC1RAB9AMEN1TP53MAPT | |
| SCHEMBL12259927 | 0.70 | CYP3A4 (0.56) | NPC1RAB9AMEN1TP53MAPT | |
| SCHEMBL17209585 | 0.69 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL11705130 | 0.69 | ALDH1A1 (0.44) | RAB9ATP53MAPTALDH1A1 |
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-0000030-B1 | DIURETHANES CONTAINING SULPHUR, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES | BASF Aktiengesellschaft (DE) | 1980-12-10 | — | — | EP | disclosed |