Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.46 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | TACR2 | P21452 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SHBG | P04278 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27563780 | 1.00 | KCNH2 (0.54) | KCNH2GPR84LIPGESR1ADRA2A | |
| SCHEMBL9695394 | 1.00 | KCNH2 (0.54) | KCNH2GPR84LIPGESR1ADRA2A | |
| SCHEMBL11852687 | 0.98 | KCNH2 (0.50) | KCNH2GPR84LIPGESR1ADRA2A | |
| Hydrochloric Acid SCHEMBL28535389 | 0.96 | KCNH2 (0.50) | KCNH2GPR84LIPGESR1ADRA2A | |
| Cyanide SCHEMBL27976702 | 0.91 | KCNH2 (0.45) | KCNH2GPR84LIPGESR1ADRA2A | |
| SCHEMBL9240455 | 0.90 | SKP2 (0.42) | KCNH2KDM4EALDH1A1HSD17B10ACHE | |
| SCHEMBL8096579 | 0.90 | CYP2A6 (0.43) | KCNH2ALDH1A1LMNAHSD17B10CHRM2 | |
| SCHEMBL8097070 | 0.90 | CYP2A6 (0.43) | KCNH2ALDH1A1LMNAHSD17B10CHRM2 | |
| SCHEMBL8097074 | 0.90 | CYP2A6 (0.43) | KCNH2ALDH1A1LMNAHSD17B10CHRM2 | |
| SCHEMBL8093240 | 0.90 | CYP2A6 (0.43) | KCNH2ALDH1A1LMNAHSD17B10CHRM2 |
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-109666792-A | A kind of method of rare-earth extractant and rare-earth separating yttrium | 厦门熙途科技有限公司 | 2019-04-23 | — | — | CN | disclosed |