Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 5/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | FBP1 | P09467 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21268413 | 0.81 | TGM2 (0.34) | CES2CES1KIF11ALDH1A1TSHR | |
| SCHEMBL27953248 | 0.71 | MAPT (0.33) | KIF11CA1CA2CA9 | |
| SCHEMBL27844712 | 0.71 | CES2 (0.33) | CES2KIF11CA1CA2FBP1 | |
| SCHEMBL221733 | 0.70 | ALDH1A1 (0.36) | CES2CES1KIF11ALDH1A1TSHR | |
| SCHEMBL60519 | 0.70 | ALDH1A1 (0.36) | CES2CES1KIF11EPHX2ALDH1A1 | |
| SCHEMBL15066847 | 0.70 | — | — | |
| SCHEMBL27761614 | 0.70 | CES2 (0.35) | CES2CES1KIF11CA1CA2 | |
| SCHEMBL7047181 | 0.69 | CES2 (0.36) | CES2CES1KIF11CA1CA2 | |
| SCHEMBL7474647 | 0.69 | EPHX2 (0.38) | CES1KIF11EPHX2KMT2A | |
| SCHEMBL272417 | 0.68 | KIF11 (0.43) | CES2CES1KIF11ALDH1A1TSHR |
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-103547563-B | Biphenyl derivatives useful as glucagon receptor antagonists | JANSSEN PHARMACEUTICA N.V. (BE) | 2016-03-23 | — | — | CN | disclosed |