Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL903504 | 0.83 | MCL1 (0.33) | MCL1 | |
| SCHEMBL903791 | 0.75 | PIK3CA (0.33) | — | |
| SCHEMBL10217749 | 0.74 | MAOB (0.40) | MCL1 | |
| SCHEMBL18057087 | 0.74 | MAOB (0.40) | MCL1 | |
| SCHEMBL903685 | 0.71 | ACLY (0.34) | — | |
| SCHEMBL903682 | 0.71 | ACLY (0.34) | — | |
| SCHEMBL903674 | 0.71 | SIRT2 (0.31) | — | |
| SCHEMBL19318923 | 0.70 | PIK3CA (0.31) | — | |
| SCHEMBL903802 | 0.66 | ACLY (0.39) | — | |
| SCHEMBL2209905 | 0.61 | AHR (0.50) | PBRM1AHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012040923-A1 | TETRACYCLIC INDOLE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |
| WO-2012041014-A1 | TETRACYCLIC INDOLE DERIVATIVES FOR TREATING HEPATITIS C VIRUS INFECTION | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |