Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GRN | P28799 | 1/20 | 0.33 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.33 |
| ▸ | USP4 | Q13107 | 1/20 | 0.32 |
| ▸ | USP7 | Q93009 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2783116 | 0.82 | CYP2C9 (0.54) | CYP2C9KMT2AMEN1POLBTDP1 | |
| SCHEMBL17838295 | 0.81 | CYP1A2 (0.55) | CYP2C9KMT2AMEN1POLBPKM | |
| SCHEMBL2361283 | 0.79 | CYP2C9 (0.51) | CYP2C9KMT2AMEN1POLBTDP1 | |
| SCHEMBL24158944 | 0.77 | CYP2C9 (0.50) | CYP2C9KMT2AMEN1POLBTDP1 | |
| SCHEMBL27312350 | 0.76 | USP4 (0.51) | CYP2C9KMT2AMEN1POLBTDP1 | |
| SCHEMBL16417130 | 0.75 | CYP2C9 (0.43) | CYP2C9KMT2AMEN1POLBTDP1 | |
| SCHEMBL16416929 | 0.75 | KMT2A (0.43) | CYP2C9KMT2AMEN1POLBTDP1 | |
| SCHEMBL3674837 | 0.74 | TDP1 (0.46) | CYP2C9KMT2AMEN1POLBTDP1 | |
| SCHEMBL1149847 | 0.73 | CYP2C9 (0.60) | CYP2C9KMT2AMEN1POLBTDP1 | |
| SCHEMBL1277680 | 0.72 | KMT2A (0.53) | CYP2C9KMT2AMEN1POLBTDP1 |
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-108047115-B | Glyoxylamide-substituted pyrrole amide derivatives and their use as medicaments for the treatment of hepatitis B | 爱尔兰詹森科学公司 | 2021-06-29 | — | — | CN | disclosed |