Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 6/20 | 0.53 |
| ▸ | KCNK9 | Q9NPC2 | 6/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3461999 | 0.81 | NPC1 (0.44) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4371423 | 0.81 | PARP1 (0.58) | KCNK3KCNK9POLBPARP1NPC1 | |
| SCHEMBL29530873 | 0.79 | POLB (0.72) | KCNK3KCNK9POLBPARP1NPC1 | |
| SCHEMBL16105761 | 0.79 | KCNK3 (0.51) | KCNK3KCNK9POLBPARP1NPC1 | |
| SCHEMBL11612584 | 0.79 | POLB (0.72) | KCNK3KCNK9POLBPARP1NPC1 | |
| SCHEMBL7643456 | 0.78 | AKR1C3 (0.46) | NPC1RAB9ASMN1; SMN2MEN1KMT2A | |
| Acetophenone SCHEMBL16178575 | 0.78 | KCNK3 (0.61) | KCNK3KCNK9POLBPARP1NPC1 | |
| SCHEMBL2451836 | 0.76 | TSHR (0.50) | POLBSMN1; SMN2KMT2AACHE | |
| SCHEMBL7055429 | 0.75 | PARP1 (0.73) | KCNK3KCNK9POLBPARP1NPC1 | |
| SCHEMBL9712399 | 0.75 | KCNK3 (0.55) | KCNK3KCNK9POLBPARP1NPC1 |
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-3728214-A1 | SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES | Bayer Aktiengesellschaft (DE) | 2020-10-28 | — | — | EP | disclosed |
| EP-1678185-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042542-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2005-05-12 | — | — | WO | disclosed |