Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.36 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28538573 | 0.85 | ALDH1A1 (0.39) | TSHRLMNAXBP1HTTNOD1 | |
| SCHEMBL28555375 | 0.83 | RAB9A (0.40) | LMNAHTTNOD1NOD2GAA | |
| SCHEMBL17814738 | 0.79 | TNF (0.42) | TSHRLMNAHTTNOD1TNF | |
| SCHEMBL29172435 | 0.72 | P2RX3 (0.42) | LMNANOD1GAAP2RX3CYP2C9 | |
| SCHEMBL28547235 | 0.68 | RAB9A (0.45) | LMNANOD1TNFCXCL8SOS1 | |
| SCHEMBL17814735 | 0.66 | PNP (0.57) | KMT2ATLR7NPC1 | |
| SCHEMBL30804819 | 0.61 | BRD4 (0.42) | TSHRLMNAXBP1SMN1; SMN2KDM4E | |
| SCHEMBL11719377 | 0.61 | P2RX3 (0.54) | TSHRLMNAHTTSMN1; SMN2KDM4E | |
| SCHEMBL4844448 | 0.59 | HTT (0.58) | HTTGAASMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL11225020 | 0.59 | GSK3A (0.67) | LMNAHTTSMN1; SMN2KDM4EALDH1A1 |
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-112409331-A | Heterocyclic derivative inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2021-02-26 | — | — | CN | disclosed |