Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.47 |
| ▸ | RELA | Q04206 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | STAT1 | P42224 | 1/20 | 0.46 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30184310 | 0.89 | MAPK13 (0.44) | KDM4EHPGDALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL30309818 | 0.86 | KDM4E (0.46) | KDM4EALDH1A1GPR119MAPK13LIMK1 | |
| SCHEMBL20678782 | 0.82 | KDM4E (0.54) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL11472378 | 0.78 | MAP2K1 (0.65) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL25162487 | 0.77 | KDM4E (0.63) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL4794157 | 0.76 | KDM4E (0.61) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL21948058 | 0.76 | KDM4E (0.47) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL20688848 | 0.76 | TYK2 (0.54) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL4894562 | 0.75 | NPC1 (0.60) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL26622020 | 0.75 | KDM4E (0.67) | NPC1RAB9AKDM4EHPGDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023078267-A1 | AMINO-CONTAINING MACROCYCLIC COMPOUND AS PROTEIN KINASE MODULATOR | 赛诺哈勃药业（成都）有限公司 | 2023-05-11 | — | — | WO | disclosed |
| CN-116063324-A | Inhibitors of BTK and/or RET having macrocyclic structure | 赛诺哈勃药业（成都）有限公司 | 2023-05-05 | — | — | CN | disclosed |
| CN-116063326-A | Amino-containing macrocyclic compounds as protein kinase modulators | 赛诺哈勃药业（成都）有限公司 | 2023-05-05 | — | — | CN | disclosed |
| CN-116063305-A | Macrocyclic compounds with BTK and/or RET activity and their use in medicine | 赛诺哈勃药业（成都）有限公司 | 2023-05-05 | — | — | CN | disclosed |