Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | UBE2N | P61088 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28511981 | 0.86 | RAPGEF4 (0.44) | KMT2AALDH1A1TDP1RAPGEF4KDM4E | |
| SCHEMBL28502157 | 0.80 | GAA (0.52) | ALDH1A1TDP1HTTKDM4EMAPT | |
| SCHEMBL7112755 | 0.79 | UBE2N (0.57) | KMT2AALDH1A1TDP1UBE2NHTT | |
| SCHEMBL28504347 | 0.75 | KMT2A (0.54) | KMT2AALDH1A1TDP1HTTTSHR | |
| SCHEMBL28504346 | 0.75 | KMT2A (0.47) | KMT2AALDH1A1KDM4EMAPTGAA | |
| SCHEMBL28502156 | 0.74 | LMNA (0.48) | KMT2AALDH1A1TDP1HTTRAPGEF4 | |
| SCHEMBL11589688 | 0.74 | HTR6 (0.52) | KMT2AALDH1A1UBE2NTSHRRAPGEF4 | |
| SCHEMBL28506091 | 0.74 | CD44 (0.48) | KMT2AALDH1A1TDP1HTTTSHR | |
| SCHEMBL30963734 | 0.73 | ALDH1A1 (0.51) | KMT2AALDH1A1TDP1UBE2NHTT | |
| SCHEMBL757794 | 0.73 | ALDH1A1 (0.51) | KMT2AALDH1A1TDP1UBE2NHTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109096156-B | Disulfonyl meta-aryl diamine urease inhibitor and preparation method and application thereof | 吉首大学 | 2021-01-15 | — | — | CN | disclosed |