Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.37 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.34 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.31 |
| ▸ | PRKACG | P22612 | 1/20 | 0.31 |
| ▸ | PRKACB | P22694 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL551606 | 0.75 | CHRNB2 (0.43) | — | |
| SCHEMBL7750646 | 0.74 | — | — | |
| SCHEMBL18903009 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL19259428 | 0.74 | CHRNB2 (0.42) | HTR2C | |
| SCHEMBL978739 | 0.74 | MEN1 (0.45) | BAZ2AHTR2C | |
| SCHEMBL29285276 | 0.72 | DRD3 (0.36) | HTR2CNOS3NOS2 | |
| SCHEMBL787918 | 0.72 | CHRM2 (0.39) | HTR2CNOS3NOS2 | |
| SCHEMBL24540766 | 0.72 | CSNK1D (0.36) | BAZ2ACSNK1DCSNK1EKCNH2PRKACA | |
| Hydrochloric Acid SCHEMBL4573925 | 0.71 | CHRM2 (0.38) | HTR2CNOS3NOS2 | |
| SCHEMBL31610616 | 0.70 | PIK3C3 (0.35) | PIK3C3NOS3NOS2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110431138-A | AR-V7 inhibitor | HOFFMANN LA ROCHE | 2019-11-08 | — | — | CN | claimed |
| CN-110431138-A | AR-V7 inhibitor | HOFFMANN LA ROCHE | 2019-11-08 | — | — | CN | disclosed |
| CN-106164071-B | Human androgenic receptor DNA- binding structural domain (DBD) compound and its application method as therapeutic agent | 不列颠哥伦比亚大学 | 2019-09-10 | — | — | CN | disclosed |
| EP-0345593-B2 | 2-substituted coumaran derivatives | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1998-02-04 | — | — | EP | disclosed |
| EP-0345593-A1 | 2-substituted coumaran derivatives | Takeda Chemical Industries, Ltd. (JP) | 1989-12-13 | — | — | EP | disclosed |