Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR2 | P25025 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | CX3CR1 | P49238 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.31 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | FLT1 | P17948 | 1/20 | 0.30 |
| ▸ | FLT4 | P35916 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28140897 | 0.81 | FLT1 (0.33) | FLT1FLT4KDR | |
| SCHEMBL27294789 | 0.77 | ALDH1A1 (0.47) | ALDH1A1LMNAKMT2AATMALOX15 | |
| SCHEMBL28253353 | 0.76 | ALOX15 (0.33) | ALDH1A1LMNAKMT2AATMALOX15 | |
| SCHEMBL967909 | 0.74 | CYP3A4 (0.44) | ALDH1A1KMT2AATMALOX15KDM4E | |
| SCHEMBL103521 | 0.73 | ALDH1A1 (0.44) | ALDH1A1KMT2AATMALOX15KDM4E | |
| SCHEMBL20501204 | 0.73 | TSHR (0.47) | ALDH1A1LMNAKMT2AALOX15KDM4E | |
| SCHEMBL2791614 | 0.72 | LMNA (0.35) | CXCR2ALDH1A1LMNAKMT2AATM | |
| SCHEMBL9197331 | 0.71 | ALDH1A1 (0.45) | ALDH1A1LMNAALOX15SLC1A3SLC1A2 | |
| SCHEMBL7707415 | 0.71 | ALDH1A1 (0.54) | ALDH1A1KMT2AATMALOX15KDM4E | |
| SCHEMBL149954 | 0.69 | LMNA (0.37) | ALDH1A1LMNAKMT2AMAPTTSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110179777-A | Medical composition comprising nitroxyl donors | 卡尔迪奥克斯尔制药公司 | 2019-08-30 | — | — | CN | disclosed |
| CN-105142627-B | Pharmaceutical compositions comprising nitroxyl donors | 卡尔迪奥克斯尔制药公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-105130855-B | Succinylated hydroxy amine derivatives and application thereof | 约翰斯霍普金斯大学 | 2018-05-25 | — | — | CN | disclosed |
| CN-104119310-B | N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors, and medical compositions containing same | 约翰斯霍普金斯大学 | 2017-04-12 | — | — | CN | disclosed |