Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 5/20 | 0.39 |
| ▸ | HRH1 | P35367 | 5/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | TRPC6 | Q9Y210 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29742102 | 0.84 | MAPT (0.42) | SMN1; SMN2LMNAPOLBHRH2HRH1 | |
| SCHEMBL27694790 | 0.82 | MAPT (0.49) | SMN1; SMN2LMNAPOLBHRH2HRH1 | |
| SCHEMBL29741868 | 0.81 | GPR119 (0.50) | SMN1; SMN2LMNAPOLBMAPTGPR119 | |
| SCHEMBL14915312 | 0.80 | TRPC6 (0.39) | SMN1; SMN2TRPC6GPR119KDM4E | |
| SCHEMBL30643624 | 0.76 | GPR119 (0.43) | SMN1; SMN2LMNAPOLBHRH2HRH1 | |
| SCHEMBL29742086 | 0.76 | BTK (0.39) | HRH2HRH1 | |
| SCHEMBL29741995 | 0.74 | GPR119 (0.39) | SMN1; SMN2LMNAPOLBHRH2HRH1 | |
| SCHEMBL29742014 | 0.72 | TRPC6 (0.50) | SMN1; SMN2LMNAPOLBHRH2HRH1 | |
| SCHEMBL28615895 | 0.72 | SMN1; SMN2 (0.48) | SMN1; SMN2LMNAPOLBHRH2HRH1 | |
| SCHEMBL29741969 | 0.70 | HPGD (0.40) | SMN1; SMN2LMNAPOLBHRH2HRH1 |
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-4050012-A1 | PYRIDONE BORONATES FOR THE PREPARATION OF INHIBITORS OF BTK ACTIVITY | F. Hoffmann-La Roche AG (CH) | 2022-08-31 | — | — | EP | disclosed |
| EP-4019508-A1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY | F. Hoffmann-La Roche AG (CH) | 2022-06-29 | — | — | EP | disclosed |