Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | CNR1 | P21554 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8924136 | 0.85 | SLC6A4 (0.38) | ALDH1A1TDP1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL8926547 | 0.82 | BTK (0.46) | POLBALDH1A1LMNACASP6CTDSP1 | |
| SCHEMBL16888429 | 0.76 | ALDH1A1 (0.56) | POLBALDH1A1LMNACASP6CTDSP1 | |
| SCHEMBL4858485 | 0.76 | POLB (0.43) | POLBALDH1A1LMNACASP6CTDSP1 | |
| SCHEMBL10708947 | 0.76 | POLB (0.43) | POLBALDH1A1LMNACASP6CTDSP1 | |
| SCHEMBL4862576 | 0.76 | POLB (0.43) | POLBALDH1A1LMNACASP6CTDSP1 | |
| Formaldehyde SCHEMBL27526645 | 0.73 | ALDH1A1 (0.53) | POLBALDH1A1LMNATDP1GAA | |
| Hydrochloric Acid SCHEMBL8926756 | 0.73 | ALDH1A1 (0.41) | POLBALDH1A1LMNATDP1GAA | |
| Acetaldehyde SCHEMBL27540804 | 0.70 | ALDH1A1 (0.50) | POLBALDH1A1LMNACASP6CTDSP1 | |
| SCHEMBL10778292 | 0.69 | — | — |
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 |