Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 5/20 | 0.38 |
| ▸ | HTR2B | P41595 | 4/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | EP300 | Q09472 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL29469863 | 1.00 | RIPK1 (0.44) | RIPK1HTR2CHTR2BHTR2AKDM4E | |
| SCHEMBL24334343 | 0.84 | KDM4E (0.54) | RIPK1HTR2CHTR2BHTR2AKDM4E | |
| SCHEMBL20206824 | 0.81 | RIPK1 (0.44) | RIPK1HTR2CHTR2BHTR2AKDM4E | |
| SCHEMBL24314185 | 0.81 | KDM4E (0.47) | KDM4E | |
| SCHEMBL20347948 | 0.79 | RIPK1 (0.45) | RIPK1HTR2CHTR2BHTR2AKDM4E | |
| SCHEMBL20347946 | 0.78 | DUT (0.46) | RIPK1HTR2CHTR2BHTR2AEP300 | |
| SCHEMBL18120365 | 0.78 | RIPK1 (0.44) | RIPK1HTR2CHTR2BCNR1CNR2 | |
| SCHEMBL24314284 | 0.78 | RIPK1 (0.41) | RIPK1HTR2CHTR2BHTR2AKDM4E | |
| SCHEMBL22588350 | 0.77 | ALDH1A1 (0.47) | RIPK1ALDH1A1HSD17B10NPSR1HTT | |
| SCHEMBL25111149 | 0.77 | PDE4B (0.56) | PDE4BPDE4APDE4CPDE4D |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022081807-A1 | SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER | THE BROAD INSTITUTE, INC. (US) | 2022-04-21 | — | — | WO | disclosed |
| WO-2022081842-A1 | SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER | THE BROAD INSTITUTE, INC. (US) | 2022-04-21 | — | — | WO | disclosed |