Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 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 | |
|---|---|---|---|---|
| SCHEMBL14409016 | 0.78 | CYP11B1 (0.52) | CYP11B1CYP11B2LMNANPC1RAB9A | |
| SCHEMBL10183130 | 0.76 | SLC6A3 (0.42) | ALDH1A1MAPTHPGD | |
| SCHEMBL16402703 | 0.75 | SMN1; SMN2 (0.44) | CYP11B1CYP11B2LMNANPC1RAB9A | |
| SCHEMBL19067626 | 0.73 | CYP11B1 (0.33) | CYP11B1CYP11B2LMNANPC1RAB9A | |
| SCHEMBL28015771 | 0.72 | CYP11B1 (0.38) | CYP11B1CYP11B2SRCZAP70SYK | |
| SCHEMBL13174736 | 0.70 | HDAC3 (0.39) | — | |
| SCHEMBL10013471 | 0.69 | SNCA (0.51) | CYP11B1CYP11B2SRCZAP70SYK | |
| SCHEMBL12394759 | 0.69 | ALDH1A1 (0.33) | LMNANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL12648598 | 0.69 | KMT2A (0.44) | LMNARAB9ASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL28028476 | 0.69 | FBP1 (0.31) | ALDH1A1HPGD |
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-109796499-A | Metal complexes of azabenzothiazoles containing nitrogen | 北京夏禾科技有限公司 | 2019-05-24 | — | — | CN | disclosed |