Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27891739 | 0.94 | ABCB1 (0.41) | KMT2AMEN1ATMCYP19A1MAPK1 | |
| SCHEMBL27908738 | 0.88 | ABCB1 (0.42) | KMT2ASMN1; SMN2NPC1POLBGAA | |
| SCHEMBL27891745 | 0.83 | RCE1 (0.42) | KMT2AMAPK1SMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL27891766 | 0.83 | ABCB1 (0.46) | KMT2ASMN1; SMN2NPC1POLBGAA | |
| SCHEMBL27891762 | 0.81 | CYP19A1 (0.47) | KMT2AMEN1ATMCYP19A1MAPK1 | |
| SCHEMBL27891723 | 0.78 | KDM4E (0.43) | KMT2AMEN1ATMCYP19A1MAPK1 | |
| SCHEMBL27891786 | 0.77 | ABCB1 (0.42) | SMN1; SMN2KDM4EHSD17B10L3MBTL1NPC1 | |
| SCHEMBL27891716 | 0.76 | CYP19A1 (0.56) | KMT2AMEN1CYP19A1MAPK1SMN1; SMN2 | |
| SCHEMBL27891734 | 0.76 | MCL1 (0.51) | KMT2AMEN1ATMCYP19A1KDM4E | |
| SCHEMBL27979707 | 0.74 | CYP19A1 (0.53) | KMT2AMEN1CYP19A1MAPK1SMN1; SMN2 |
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-102146080-B | Beta-carboline alkali derivative compounds and application thereof | XINJIANG HUASHIDAN PHARMACEUTICAL CO LTD | 2013-01-30 | — | — | CN | disclosed |