Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 2/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.50 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.47 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 9/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27962863 | 0.82 | GABRG2 (0.61) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL30022454 | 0.78 | CHRM2 (0.59) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL13696680 | 0.78 | CHRM2 (0.59) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL27962862 | 0.78 | GABRG2 (0.65) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL27905854 | 0.78 | GABRG2 (0.51) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL27905863 | 0.75 | CHRM2 (0.49) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL28583285 | 0.74 | KDM4E (0.61) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL15280123 | 0.74 | CHRM2 (0.50) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL27985045 | 0.74 | CHRM2 (0.50) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL16064623 | 0.73 | CHRM2 (0.50) | GABRG2GABRB3GABRA5GABRA1GABRA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103145705-B | Beta-carboline alkaloid derivative, its preparation method and medicinal use thereof | NANTONG UNIVERSITY (CN) | 2016-04-06 | — | — | CN | disclosed |
| CN-103145705-A | Beta-carboline alkaloid derivatives and their preparation method and medical use | UNIV NANTONG | 2013-06-12 | — | — | CN | disclosed |