Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SLC16A3 | O15427 | 3/20 | 0.34 |
| ▸ | SLC16A1 | P53985 | 3/20 | 0.34 |
| ▸ | MCTS1 | Q9ULC4 | 3/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21526022 | 0.80 | SMN1; SMN2 (0.46) | SMN1; SMN2MAPTALDH1A1HTR2CENPP1 | |
| SCHEMBL21526015 | 0.77 | SMN1; SMN2 (0.43) | SMN1; SMN2MAPTALDH1A1ENPP1LMNA | |
| SCHEMBL13603792 | 0.72 | IDO1 (0.55) | MAPTALDH1A1TAAR1IDO1SLC6A2 | |
| SCHEMBL21526131 | 0.68 | SMN1; SMN2 (0.64) | SMN1; SMN2MAPTALDH1A1ENPP1ADORA2A | |
| SCHEMBL18762206 | 0.68 | HTR2C (0.48) | SMN1; SMN2ALDH1A1HTR2CHTR2BTAAR1 | |
| SCHEMBL23955986 | 0.67 | SMN1; SMN2 (0.31) | SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL22050338 | 0.64 | LMNA (0.38) | SMN1; SMN2MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL672407 | 0.64 | IDO1 (0.62) | TAAR1IDO1LMNASLC6A2SLC6A4 | |
| SCHEMBL29519238 | 0.64 | IDO1 (0.62) | TAAR1IDO1LMNASLC6A2SLC6A4 | |
| SCHEMBL28811623 | 0.63 | SMN1; SMN2 (0.44) | SMN1; SMN2MAPTALDH1A1HTR2CHTR2B |
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-110198930-A | Pyrimidine derivatives | 第一三共株式会社 | 2019-09-03 | — | — | CN | disclosed |