Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.59 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.49 |
| ▸ | TUBB | P07437 | 1/20 | 0.49 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.49 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.49 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.49 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.49 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.49 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.49 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.49 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.49 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.49 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.49 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.49 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.49 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2098026 | 0.84 | CA12 (0.52) | MGLLTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29439366 | 0.74 | MGLL (1.00) | MGLLGAAMAPTALDH1A1MEN1 | |
| SCHEMBL141734 | 0.74 | MGLL (1.00) | MGLLGAAMAPTALDH1A1MEN1 | |
| SCHEMBL10916413 | 0.74 | MGLL (0.55) | MGLLTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL6559666 | 0.73 | TUBB4A (0.49) | MGLLTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL12841493 | 0.72 | MEN1 (0.49) | MGLLGAAMAPTALDH1A1HPGD | |
| SCHEMBL7981999 | 0.72 | GAA (0.58) | MGLLGAAMAPTALDH1A1HPGD | |
| SCHEMBL20917333 | 0.72 | TUBB4A (0.65) | MGLLTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL28842652 | 0.71 | MGLL (0.57) | MGLLGAAALDH1A1KMT2AKDM4E | |
| SCHEMBL31149024 | 0.70 | CYP19A1 (0.67) | GAAMAPTALDH1A1HPGDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0006628-B1 | SUBSTITUTED DIHYDROPYRIDINE UREAS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1982-12-29 | — | — | EP | disclosed |
| EP-0006628-A1 | Substituted dihydropyridine ureas, process for preparing the same and pharmaceutical compositions containing them | MERCK & CO. INC. (US) | 1980-01-09 | — | — | EP | disclosed |
| US-4176187-A | HYPOTENSIVE AGENTS | MERCK & CO., INC. (US) | 1979-11-27 | — | — | US | disclosed |