Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | ILK | Q13418 | 1/20 | 0.36 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23458507 | 0.84 | RAB9A (0.68) | NPC1RAB9AKDM4EILKCDC7 | |
| SCHEMBL26833283 | 0.78 | RAB9A (0.64) | NPC1RAB9AKDM4EILKALDH1A1 | |
| SCHEMBL3469331 | 0.78 | RAB9A (0.64) | NPC1RAB9AKDM4EILKALDH1A1 | |
| SCHEMBL28561310 | 0.78 | NPC1 (0.54) | NPC1RAB9AKDM4ECYP2A6CYP3A4 | |
| SCHEMBL29606206 | 0.78 | RAB9A (0.64) | NPC1RAB9AKDM4EILKALDH1A1 | |
| SCHEMBL25028306 | 0.78 | KDM4E (0.43) | NPC1RAB9AKDM4ECYP2A6PDGFRB | |
| SCHEMBL20519963 | 0.77 | RAB9A (0.76) | NPC1RAB9AKDM4ECYP2A6CYP3A4 | |
| SCHEMBL221542 | 0.75 | APP (0.63) | NPC1RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL15164320 | 0.75 | RAB9A (0.51) | NPC1RAB9AKDM4EALDH1A1LMNA | |
| SCHEMBL31670522 | 0.75 | RAB9A (0.51) | NPC1RAB9AKDM4EALDH1A1LMNA |
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-108373476-B | Kinase inhibitor and preparation and application thereof | 成都地奥制药集团有限公司 | 2021-06-01 | — | — | CN | disclosed |