Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7896851 | 0.86 | KDM4E (0.57) | KDM4ERAB9ANPC1NR2F2KMT2A | |
| SCHEMBL28267245 | 0.79 | PLAA (0.59) | KDM4ERAB9ANPC1NR2F2KMT2A | |
| SCHEMBL28840519 | 0.77 | PTPN1 (0.56) | KDM4ERAB9ANPC1NR2F2MAPT | |
| SCHEMBL1509735 | 0.77 | CYP19A1 (0.71) | TDP1ALDH1A1L3MBTL1 | |
| SCHEMBL6247518 | 0.77 | NPC1 (0.59) | KDM4ERAB9ANPC1KMT2AMEN1 | |
| SCHEMBL10656937 | 0.76 | TSHR (0.59) | KDM4ERAB9AKMT2AMEN1RECQL | |
| Hydrochloric Acid SCHEMBL410578 | 0.76 | CYP19A1 (0.69) | TDP1ALDH1A1L3MBTL1 | |
| SCHEMBL4983149 | 0.75 | HTT (0.53) | KDM4ERAB9ANPC1KMT2AMEN1 | |
| SCHEMBL4875267 | 0.74 | ALDH1A1 (0.79) | KDM4EKMT2AMEN1MAPK1MAPT | |
| Bromide SCHEMBL3844582 | 0.74 | LMNA (0.74) | KDM4ERAB9ANPC1NR2F2KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106366075-B | Pyrrolidines, salt, nuclear-magnetism probe and medicinal application, reagent, drug | 北京市神经外科研究所 | 2018-06-12 | — | — | CN | disclosed |
| CN-106366075-A | Pyrrolidine compounds, salts thereof, applications of compounds or salts thereof in nuclear magnetic probes and medicines, reagent, and medicine | 北京市神经外科研究所 | 2017-02-01 | — | — | CN | disclosed |