Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.44 |
| ▸ | HTT | P42858 | 5/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 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 | |
|---|---|---|---|---|
| SCHEMBL28323196 | 0.82 | HTT (0.42) | SMN1; SMN2HTTMAP4K4RAB9AALDH1A1 | |
| SCHEMBL21526137 | 0.77 | SMN1; SMN2 (0.41) | SMN1; SMN2HTTLMNAHPGDCRHR1 | |
| Tert-Butyl Formate SCHEMBL28876913 | 0.75 | HTT (0.39) | SMN1; SMN2HTTMAP4K4RAB9AHPGD | |
| SCHEMBL28322161 | 0.74 | SMN1; SMN2 (0.50) | SMN1; SMN2HTTMAP4K4LMNARAB9A | |
| SCHEMBL28323179 | 0.70 | SMN1; SMN2 (0.43) | SMN1; SMN2HTTLMNARAB9AALDH1A1 | |
| SCHEMBL21526087 | 0.69 | HPGD (0.39) | SMN1; SMN2HTTHPGDGAA | |
| SCHEMBL21526073 | 0.69 | SMN1; SMN2 (0.44) | SMN1; SMN2HTTLMNAALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL21526127 | 0.68 | SMN1; SMN2 (0.43) | SMN1; SMN2HTTLMNAALDH1A1HPGD | |
| SCHEMBL28323174 | 0.68 | SMN1; SMN2 (0.49) | SMN1; SMN2HTTLMNARAB9AALDH1A1 | |
| SCHEMBL21526051 | 0.66 | SMN1; SMN2 (0.39) | SMN1; SMN2HTTHPGDL3MBTL1GAA |
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 |