Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 2/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8926500 | 0.82 | POLB (0.40) | KMT2AGAAALDH1A1POLBLMNA | |
| SCHEMBL23646375 | 0.72 | BTK (0.49) | BTKNFKB1NFKB2RELAKDM1A | |
| SCHEMBL8924136 | 0.72 | SLC6A4 (0.38) | KMT2AALDH1A1TDP1 | |
| SCHEMBL29046653 | 0.71 | BTK (0.47) | BTKNFKB1NFKB2RELAKDM1A | |
| SCHEMBL29046655 | 0.71 | BTK (0.47) | BTKNFKB1NFKB2RELAKDM1A | |
| SCHEMBL17963651 | 0.71 | BTK (0.61) | BTKNFKB1NFKB2RELAKDM1A | |
| SCHEMBL21827913 | 0.71 | BTK (0.61) | BTKNFKB1NFKB2RELAKDM1A | |
| SCHEMBL13137498 | 0.71 | BTK (0.61) | BTKNFKB1NFKB2RELAKDM1A | |
| SCHEMBL25401362 | 0.71 | BTK (0.61) | BTKNFKB1NFKB2RELAKDM1A | |
| SCHEMBL3056110 | 0.71 | BTK (0.61) | BTKNFKB1NFKB2RELAKDM1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5622916-A | PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-04-22 | — | — | US | disclosed |
| US-5296503-A | Administering orally | BAYER AKTIENGESELLSCHAFT (DE) | 1994-03-22 | — | — | US | disclosed |
| US-5270340-A | Substituted 2-cyclohexen-1-yl-amine fungicidal and herbicidal agents | BAYER AKTIENGESELLSCHAFT (DE) | 1993-12-14 | — | — | US | disclosed |