Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | GRK6 | P43250 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL27891783 | 0.94 | CYP19A1 (0.45) | CYP19A1MEN1KMT2AATMLMNA | |
| SCHEMBL27908727 | 0.87 | SLC6A4 (0.43) | KMT2ALMNAMAPTPOLBGRK6 | |
| SCHEMBL27891741 | 0.82 | RCE1 (0.41) | MEN1KMT2ALMNAMAPTPOLB | |
| SCHEMBL27908744 | 0.82 | SLC6A4 (0.47) | KMT2ALMNAMAPTPOLBGRK6 | |
| SCHEMBL27891749 | 0.81 | KMT2A (0.42) | CYP19A1MEN1KMT2AATMPOLB | |
| SCHEMBL27891731 | 0.80 | KDM4E (0.45) | CYP19A1MEN1KMT2AATMLMNA | |
| SCHEMBL27891748 | 0.77 | MEN1 (0.44) | CYP19A1MEN1KMT2AATMLMNA | |
| SCHEMBL27908739 | 0.76 | SLC6A4 (0.43) | LMNAMAPTPOLBGRK6KDM4E | |
| SCHEMBL27891734 | 0.76 | MCL1 (0.51) | CYP19A1MEN1KMT2AATMLMNA | |
| SCHEMBL2215668 | 0.72 | CYP19A1 (0.58) | CYP19A1MEN1KMT2AMAPTPOLB |
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 |