Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.34 |
| ▸ | ACP3 | P15309 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CASR | P41180 | 1/20 | 0.33 |
| ▸ | COMT | P21964 | 1/20 | 0.33 |
| ▸ | ACP1 | P24666 | 1/20 | 0.32 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.32 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.32 |
| ▸ | PTPN13 | Q12923 | 1/20 | 0.32 |
| ▸ | SSU72 | Q9NP77 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | G6PD | P11413 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28111192 | 0.89 | CASR (0.37) | ACP3KDM4ECASRPTGS2 | |
| SCHEMBL28111761 | 0.75 | IDO1 (0.47) | ACP3PPARGDRD4KDM4ECASR | |
| SCHEMBL31013537 | 0.73 | ALDH1A1 (0.46) | DRD4COMTLMNATP53MAPT | |
| SCHEMBL28102822 | 0.71 | HSP90AA1 (0.42) | HTTKDM4EKMT2APTGS2ALDH1A1 | |
| SCHEMBL1272692 | 0.68 | CYP2C19 (0.48) | KDM4ELMNAKMT2AMAPTALDH1A1 | |
| SCHEMBL28121740 | 0.63 | TSHR (0.52) | HTTPTGS2MAPTALDH1A1 | |
| SCHEMBL28199860 | 0.61 | CA2 (0.35) | ALDH1A1 | |
| SCHEMBL22288889 | 0.61 | HPGD (0.34) | LMNAALDH1A1 | |
| SCHEMBL11937825 | 0.61 | KDM4E (0.59) | KDM4EALDH1A1 | |
| SCHEMBL14974088 | 0.59 | ALDH1A1 (0.46) | HTTKMT2AALDH1A1 |
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-106257976-A | Human plasma kallikrein inhibitors | 拜奥克里斯特制药公司 | 2016-12-28 | — | — | CN | disclosed |