Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | DHFR | P00374 | 2/20 | 0.46 |
| ▸ | P2RX3 | P56373 | 7/20 | 0.43 |
| ▸ | P2RX2 | Q9UBL9 | 7/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | C1S | P09871 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29439836 | 0.85 | PIK3CD (0.37) | PIK3CDP2RX3P2RX2PDGFRBKDR | |
| SCHEMBL22715950 | 0.85 | PIK3CD (0.37) | PIK3CDP2RX3P2RX2PDGFRBKDR | |
| SCHEMBL22744144 | 0.82 | DHFR (0.46) | PIK3CDKDM4EHTTNPSR1HSD17B10 | |
| SCHEMBL22744038 | 0.80 | DHFR (0.46) | NPC1RAB9AKDM4EHTTBLM | |
| SCHEMBL22744018 | 0.80 | P2RX3 (0.48) | P2RX3P2RX2MAPTTP53 | |
| SCHEMBL23870044 | 0.78 | IP6K1 (0.39) | PIK3CDNPC1RAB9AKDM4EHTT | |
| SCHEMBL29439678 | 0.78 | IP6K1 (0.39) | PIK3CDNPC1RAB9AKDM4EHTT | |
| SCHEMBL997013 | 0.75 | P2RX3 (0.60) | P2RX3 | |
| SCHEMBL22744257 | 0.75 | GRM5 (0.38) | PIK3CDDHFRP2RX3P2RX2KDR | |
| SCHEMBL2851410 | 0.74 | TRPV1 (0.61) | PIK3CDP2RX3KDR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020239999-A1 | SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE | JANSSEN PHARMACEUTICA NV (BE) | 2020-12-03 | — | — | WO | disclosed |