Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 4/20 | 0.44 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.44 |
| ▸ | CDK1 | P06493 | 4/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.44 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL903529 | 0.81 | AR (0.50) | ARLMNAHPGDGSK3BCCNB2 | |
| SCHEMBL903408 | 0.81 | AR (0.50) | ARLMNAHPGDGSK3BCCNB2 | |
| SCHEMBL10602830 | 0.78 | ALOX5 (0.66) | ARNR1I2LMNAHPGDGSK3B | |
| SCHEMBL10215238 | 0.78 | AR (0.44) | ARLMNAHPGDGSK3BCCNB2 | |
| SCHEMBL1460223 | 0.77 | CDK1 (0.46) | ARLMNAHPGDGSK3BCCNB2 | |
| SCHEMBL1460051 | 0.75 | F2 (0.58) | LMNAHPGDRXFP1KMT2AALDH1A1 | |
| SCHEMBL903788 | 0.74 | HTR2A (0.46) | ARLMNAGSK3BCCNB2CDK1 | |
| SCHEMBL30547021 | 0.73 | HPGD (0.55) | ARLMNAHPGDMAPK1RXFP1 | |
| SCHEMBL410289 | 0.73 | HPGD (0.55) | ARLMNAHPGDMAPK1RXFP1 | |
| SCHEMBL1460073 | 0.72 | AR (0.44) | ARLMNAHPGDGSK3BCCNB2 |
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-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 |