Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 7/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | NPC1 | O15118 | 6/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | GLP1R | P43220 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | IDE | P14735 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15742045 | 0.80 | HCAR3 (0.43) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL17807784 | 0.80 | HCAR3 (0.43) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL30555641 | 0.80 | HCAR3 (0.43) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL15742057 | 0.80 | SMN1; SMN2 (0.45) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL15742198 | 0.80 | GLP1R (0.50) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL10183144 | 0.77 | HCAR3 (0.41) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL10235442 | 0.77 | HCAR3 (0.41) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL7724928 | 0.77 | POLB (0.56) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL4546576 | 0.75 | HCAR3 (0.44) | HCAR3SMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL7914272 | 0.75 | DYRK1A (0.41) | SMN1; SMN2RAB9AKDM4ENPC1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-3181564-B1 | AMINOPYRIMIDINE COMPOUNDS AS INHIBITORS OF T790M CONTAINING EGFR MUTANTS | HOFFMANN LA ROCHE (CH) | 2019-09-18 | — | — | EP | disclosed |
| EP-3181564-A1 | AMINOPYRIMIDINE COMPOUNDS AS INHIBITORS OF T790M CONTAINING EGFR MUTANTS | Genentech, Inc. (US) | 2017-06-21 | — | — | EP | disclosed |