Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 11/20 | 0.56 |
| ▸ | NFATC1 | O95644 | 6/20 | 0.56 |
| ▸ | GSK3B | P49841 | 4/20 | 0.56 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.49 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.49 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 2/20 | 0.46 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.46 |
| ▸ | KDM5A | P29375 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GABRP | O00591 | 1/20 | 0.42 |
| ▸ | GABRD | O14764 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TOP1 | P11387 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18746021 | 0.83 | DYRK1A (0.56) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL3147182 | 0.75 | DYRK1A (0.56) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL29814872 | 0.75 | PIM1 (0.59) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL21917255 | 0.75 | DYRK1A (0.66) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL245511 | 0.75 | DYRK1A (0.61) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL1892610 | 0.75 | PIM1 (0.59) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL1009087 | 0.75 | DYRK1A (0.56) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL2619228 | 0.75 | DYRK1A (0.56) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL2052704 | 0.75 | DYRK1A (0.51) | DYRK1ANFATC1GSK3BPDPK1TGFBR1 | |
| SCHEMBL22305924 | 0.75 | KDM5C (0.47) | DYRK1ANFATC1GSK3BKDM5AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2884977-B1 | N-ALKYLATED INDOLE AND INDAZOLE COMPOUNDS AS RORgammaT INHIBITORS AND USES THEREOF | MERCK SHARP & DOHME (US) | 2017-10-11 | — | — | EP | disclosed |