Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4636562 | 0.86 | MAPT (0.40) | KMT2AALDH1A1HTTMAPTGAA | |
| SCHEMBL27830742 | 0.82 | KMT2A (0.41) | KMT2AALDH1A1HTTMAPTGAA | |
| SCHEMBL10584673 | 0.81 | KMT2A (0.39) | KMT2AALDH1A1HTTMAPTGAA | |
| SCHEMBL27997449 | 0.78 | LMNA (0.38) | ALDH1A1HTTMAPTGAATDP1 | |
| SCHEMBL27673491 | 0.78 | LMNA (0.42) | ALDH1A1HTTMAPTGAAPKM | |
| SCHEMBL10872973 | 0.78 | KDM4E (0.41) | ALDH1A1GAATDP1LMNARAB9A | |
| SCHEMBL11027684 | 0.77 | BCL9 (0.40) | KMT2AALDH1A1HTTMAPTGAA | |
| SCHEMBL6609300 | 0.76 | RAB9A (0.37) | KMT2AALDH1A1MAPTGAATDP1 | |
| SCHEMBL11459102 | 0.76 | KDM4E (0.38) | KMT2AALDH1A1MAPTTDP1PKM | |
| SCHEMBL27703251 | 0.76 | POLB (0.39) | ALDH1A1MAPTTDP1PKMLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-103596939-A | 5-substituted iminothiazines and their mono-and dioxides as BACE inhibitors, compositions, and their use | SCHERING CORP | 2014-02-19 | — | — | CN | disclosed |
| CN-102762551-A | Thienylpyri (mi) dinylpyrazoles and their use for controlling phytopathogenic fungi | BAYER CROPSCIENCE AG | 2012-10-31 | — | — | CN | disclosed |
| CN-1956971-A | Novel fused heterocycles and application thereof | ASTRAZENECA AB (SE) | 2007-05-02 | — | — | CN | disclosed |