Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MMP14 | P50281 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28410536 | 0.85 | KDM4E (0.49) | ALDH1A1CYP3A4SYKNSD2CASP6 | |
| SCHEMBL3663018 | 0.84 | ALDH1A1 (0.49) | ALDH1A1G6PDKDM4ESMN1; SMN2LMNA | |
| SCHEMBL2714237 | 0.81 | ALDH1A1 (0.52) | ALDH1A1KDM4ESMN1; SMN2LMNAS100A4 | |
| SCHEMBL28996531 | 0.78 | PDK2 (0.42) | ALDH1A1CYP3A4KDM4ESMN1; SMN2LMNA | |
| SCHEMBL14951063 | 0.77 | ACHE (0.50) | ALDH1A1CYP3A4SYKACHEKDM4E | |
| SCHEMBL16385223 | 0.76 | SRC (0.45) | ALDH1A1CYP3A4NSD2CASP6G6PD | |
| SCHEMBL28410115 | 0.76 | PDE2A (0.51) | ALDH1A1CYP3A4SYKNSD2CASP6 | |
| SCHEMBL4867570 | 0.75 | L3MBTL1 (0.49) | ALDH1A1CYP3A4ACHENSD2CASP6 | |
| SCHEMBL28410071 | 0.74 | MGAM (0.49) | ALDH1A1ACHENSD2CASP6G6PD | |
| SCHEMBL13017371 | 0.73 | KMT2A (0.39) | ALDH1A1CYP3A4SYKACHEKDM4E |
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-2264011-A1 | Heteroarylamidines and their use as fungicides | Bayer CropScience AG (DE) | 2010-12-22 | — | — | EP | disclosed |
| EP-2264011-A1 | Heteroarylamidines and their use as fungicides | Bayer CropScience AG (DE) | 2010-12-22 | — | — | EP | disclosed |