Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C5AR1 | P21730 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL21048801 | 0.98 | C5AR1 (0.51) | C5AR1CA12CA9HSD11B1GAA | |
| Hydrochloric Acid SCHEMBL17258967 | 0.83 | C5AR1 (0.40) | C5AR1KEAP1MAPTL3MBTL1 | |
| Hydrochloric Acid SCHEMBL21048836 | 0.82 | PGR (0.56) | KEAP1MAPTL3MBTL1LMNA | |
| SCHEMBL30621311 | 0.81 | KMT2A (0.46) | C5AR1NPSR1MAPTL3MBTL1MEN1 | |
| SCHEMBL1291311 | 0.81 | KMT2A (0.46) | C5AR1NPSR1MAPTL3MBTL1MEN1 | |
| Hydrochloric Acid SCHEMBL15333616 | 0.79 | KMT2A (0.45) | C5AR1NPSR1MAPTL3MBTL1MEN1 | |
| Hydrochloric Acid SCHEMBL30468480 | 0.79 | KMT2A (0.45) | C5AR1NPSR1MAPTL3MBTL1MEN1 | |
| SCHEMBL4770575 | 0.79 | C5AR1 (0.45) | C5AR1HSD11B1GAANPSR1NR1I2 | |
| Hydrochloric Acid SCHEMBL21048941 | 0.79 | KEAP1 (0.56) | KEAP1MAPTL3MBTL1LMNA | |
| Hydrochloric Acid SCHEMBL21048875 | 0.78 | ALOX5AP (0.38) | C5AR1MAPTMEN1KMT2AKDM4E |
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-109574863-A | A kind of synthetic method of -4 ' of 2- amino-fluoro- benzophenone | 安徽省庆云医药股份有限公司 | 2019-04-05 | — | — | CN | disclosed |