Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.49 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.41 |
| ▸ | TUBB | P07437 | 2/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.41 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.41 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.41 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.41 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.41 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5546522 | 0.81 | CYP1A1 (0.57) | CYP1A1CYP1A2CYP1B1TRPA1NFE2L2 | |
| SCHEMBL5547846 | 0.80 | CA1 (0.56) | CYP1A1CYP1A2CYP1B1TRPA1NFE2L2 | |
| SCHEMBL5540402 | 0.78 | SLC6A4 (0.42) | LMNANPC1RAB9AMAPTALOX12 | |
| SCHEMBL20509 | 0.75 | CA2 (0.56) | CYP1A2APPTSHRMAPTPOLB | |
| SCHEMBL29419589 | 0.75 | CA2 (0.56) | CYP1A2APPTSHRMAPTPOLB | |
| SCHEMBL14725300 | 0.75 | TSHR (0.46) | APPMAOBLMNATSHRMEN1 | |
| SCHEMBL130149 | 0.75 | APP (0.43) | APPTUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL5542361 | 0.75 | CYP1A1 (0.57) | CYP1A1CYP1A2CYP1B1TRPA1NFE2L2 | |
| SCHEMBL1256865 | 0.73 | CA2 (0.54) | CYP1A2APPTSHRMAPTPOLB | |
| SCHEMBL5607372 | 0.73 | CA2 (0.52) | CYP1A1CYP1A2CYP1B1APPCYP19A1 |
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-2002070469-A2 | SELECTIVE PDE3B INHIBITORS AND USE OF THE SAME IN THERAPY | ICOS CORPORATION (US) | 2002-09-12 | — | — | WO | disclosed |