Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.36 |
| ▸ | TUBB | P07437 | 2/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.36 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.36 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.36 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.36 |
| ▸ | GNG2 | P59768 | 1/20 | 0.35 |
| ▸ | GNB1 | P62873 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10257201 | 0.81 | CHRNB2 (0.41) | ACHEESR1ESR2CYP3A4HIF1A | |
| SCHEMBL10258004 | 0.81 | CHRNB2 (0.41) | ACHEESR1ESR2CYP3A4HIF1A | |
| SCHEMBL1858912 | 0.81 | CHRNB2 (0.41) | ACHEESR1ESR2CYP3A4HIF1A | |
| SCHEMBL29854642 | 0.78 | ESR1 (0.34) | ACHETUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL27203887 | 0.78 | ESR1 (0.34) | ACHETUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL31136551 | 0.78 | ESR1 (0.34) | ACHETUBB4ATUBBTUBA3CTUBA1B | |
| Hydrochloric Acid SCHEMBL30809644 | 0.77 | ACHE (0.35) | ACHEESR1ESR2CYP3A4 | |
| SCHEMBL30563632 | 0.75 | DRD2 (0.58) | ACHEDRD2DRD3 | |
| SCHEMBL26962573 | 0.75 | DRD2 (0.58) | ACHEDRD2DRD3 | |
| SCHEMBL268865 | 0.75 | DRD2 (0.58) | ACHEDRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012026403-A1 | CONDENSED RING COMPOUND | 日本曹達株式会社 (JP) | 2012-03-01 | — | — | WO | disclosed |