Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 5/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27908731 | 0.94 | MCL1 (0.49) | MCL1CYP19A1DYRK1AMEN1KMT2A | |
| SCHEMBL27891753 | 0.87 | MCL1 (0.47) | MCL1KMT2AKDM4EHSD17B10LMNA | |
| SCHEMBL27908736 | 0.85 | TSHR (0.41) | MCL1KDM4EHSD17B10LMNAMAPT | |
| SCHEMBL27891775 | 0.82 | MCL1 (0.46) | MCL1KMT2AKDM4EHSD17B10LMNA | |
| SCHEMBL27891751 | 0.81 | SLC6A4 (0.42) | ATMKDM4EHSD17B10LMNAMAPT | |
| SCHEMBL27891759 | 0.78 | MCL1 (0.48) | MCL1CYP19A1DYRK1AMEN1KMT2A | |
| SCHEMBL27891749 | 0.76 | KMT2A (0.42) | CYP19A1DYRK1AMEN1KMT2AATM | |
| SCHEMBL27891762 | 0.76 | CYP19A1 (0.47) | CYP19A1MEN1KMT2AATMKDM4E | |
| SCHEMBL27992426 | 0.74 | MCL1 (0.64) | MCL1CYP19A1DYRK1AMEN1KMT2A | |
| SCHEMBL27908712 | 0.74 | DYRK1A (0.67) | MCL1CYP19A1DYRK1AMEN1KMT2A |
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 |