Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | MPL | P40238 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.45 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.45 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28332624 | 0.81 | KMT2A (0.54) | NPC1PIM1PIM3PIM2L3MBTL1 | |
| SCHEMBL30353577 | 0.81 | FEN1 (0.57) | NPC1MPLADORA2ARAB9AKDM4E | |
| SCHEMBL22578252 | 0.81 | NPC1 (0.40) | NPC1MPLL3MBTL1MAPKAPK2TDP1 | |
| SCHEMBL15196256 | 0.81 | NPC1 (0.47) | NPC1MPLL3MBTL1CASP3SENP8 | |
| SCHEMBL8363964 | 0.81 | CYP1A2 (0.44) | NPC1L3MBTL1ADORA2ATDP1CYP1A2 | |
| SCHEMBL2354237 | 0.81 | NPC1 (0.47) | NPC1MPLL3MBTL1CASP3SENP8 | |
| SCHEMBL2350242 | 0.81 | NPC1 (0.47) | NPC1MPLL3MBTL1CASP3SENP8 | |
| SCHEMBL22578253 | 0.81 | NPC1 (0.40) | NPC1MPLL3MBTL1CASP3SENP8 | |
| SCHEMBL5140478 | 0.81 | FEN1 (0.57) | NPC1MPLADORA2ARAB9AKDM4E | |
| SCHEMBL28114442 | 0.81 | BACE1 (0.45) | NPC1MPLPIM1PIM3PIM2 |
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-109790146-A | Medical compounds | 阿尔麦克探索有限公司 | 2019-05-21 | — | — | CN | disclosed |