Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | IDH1 | O75874 | 2/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 5/20 | 0.39 |
| ▸ | FDPS | P14324 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | QPCT | Q16769 | 1/20 | 0.37 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11234254 | 1.00 | ALDH1A1 (0.47) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11235313 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11235308 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11245031 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11245034 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11238270 | 0.81 | ALDH1A1 (0.40) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11241101 | 0.81 | ALDH1A1 (0.40) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11238276 | 0.81 | ALDH1A1 (0.40) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11241098 | 0.81 | ALDH1A1 (0.40) | ALDH1A1CYP19A1ESR1IDH1TBXAS1 | |
| SCHEMBL11238833 | 0.77 | ESR1 (0.31) | CYP19A1ESR1ESR2 |
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-4359469-A | Combating pests with N-sulphenylated oxime-carbamates | BAYER AKTIENGESELLSCHAFT (DE) | 1982-11-16 | — | — | US | disclosed |
| EP-0005780-A1 | N,N'-asymmetrically substituted thio-bis-amines, process for their preparation and their use as insecticides, acaricides and nematocides | BAYER AG (DE) | 1979-12-12 | — | — | EP | disclosed |