Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 2/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 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 | |
|---|---|---|---|---|
| SCHEMBL9769174 | 0.79 | ALDH1A1 (0.49) | CDK5CCNE1CDK2TSHRSMN1; SMN2 | |
| SCHEMBL9769380 | 0.77 | CCNE1 (0.45) | CDK5CCNE1CDK2TSHRADORA1 | |
| SCHEMBL9769158 | 0.76 | CCNE1 (0.39) | CDK5CCNE1CDK2TSHRADORA1 | |
| SCHEMBL10584279 | 0.75 | LMNA (0.53) | CDK5CCNE1CDK2TSHRADORA1 | |
| SCHEMBL9769375 | 0.73 | CCNE1 (0.40) | CDK5CCNE1CDK2TSHRADORA1 | |
| SCHEMBL19699602 | 0.72 | TSHR (0.39) | CDK5CCNE1CDK2TSHRADORA1 | |
| SCHEMBL20819348 | 0.72 | ALDH1A1 (0.39) | CDK5CCNE1CDK2TSHRADORA1 | |
| SCHEMBL19699611 | 0.72 | TSHR (0.39) | CDK5CCNE1CDK2TSHRADORA1 | |
| SCHEMBL9769330 | 0.71 | ADRB2 (0.44) | TSHRSMN1; SMN2LMNAMEN1KMT2A | |
| SCHEMBL1447828 | 0.71 | TSHR (0.44) | CDK5CCNE1CDK2TSHRADORA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5019578-A | β-adrenergic agonists | MERCK & CO., INC. (US) | 1991-05-28 | — | — | US | disclosed |
| EP-0318092-A2 | Novel beta-adrenergic agonists | MERCK & CO. INC. (US) | 1989-05-31 | — | — | EP | disclosed |
| US-4816457-A | HYPOTENSIVE AGENTS, BRONCHODILATORS, EYES | MERCK & CO., INC., A CORP. OF NJ | 1989-03-28 | — | — | US | disclosed |