Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.55 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | RAD51 | Q06609 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2921891 | 0.84 | ALDH1A1 (0.57) | ALDH1A1CYP3A4MAPTALOX15KMT2A | |
| SCHEMBL11863066 | 0.81 | ALDH1A1 (0.57) | ALDH1A1CYP3A4MAPTALOX15KMT2A | |
| SCHEMBL11864377 | 0.81 | NPSR1 (0.55) | ALDH1A1CYP3A4MAPTALOX15KMT2A | |
| SCHEMBL716889 | 0.78 | MAPK1 (0.62) | ALDH1A1CYP3A4MAPTALOX15KMT2A | |
| SCHEMBL14836990 | 0.78 | TGM2 (0.55) | ALDH1A1CYP3A4MAPTALOX15KMT2A | |
| SCHEMBL29558297 | 0.76 | ALDH1A1 (0.62) | ALDH1A1CYP3A4MAPTALOX15KMT2A | |
| SCHEMBL1421363 | 0.75 | ALDH1A1 (0.48) | ALDH1A1MAPTSMN1; SMN2TP53TSHR | |
| SCHEMBL29754225 | 0.75 | ALDH1A1 (0.48) | ALDH1A1MAPTSMN1; SMN2TP53TSHR | |
| SCHEMBL13322448 | 0.75 | CYP1A2 (0.50) | ALDH1A1CYP3A4MAPTALOX15KMT2A | |
| SCHEMBL11032854 | 0.74 | ALDH1A1 (0.45) | ALDH1A1CYP3A4MAPTALOX15KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0000030-B1 | DIURETHANES CONTAINING SULPHUR, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES | BASF Aktiengesellschaft (DE) | 1980-12-10 | — | — | EP | disclosed |
| US-4226613-A | Bisthiocarbamic acid esters and herbicidal use thereof | BASF AKTIENGESELLSCHAFT (DE) | 1980-10-07 | — | — | US | disclosed |