Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 7/20 | 0.67 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.67 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.54 |
| ▸ | CA12 | O43570 | 9/20 | 0.48 |
| ▸ | CA9 | Q16790 | 8/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8671286 | 0.90 | HDAC1 (0.55) | HDAC1HDAC2RAB9AADRA1DADRA1A | |
| SCHEMBL8668118 | 0.86 | HDAC1 (0.57) | HDAC1HDAC2RAB9AADRA1DADRA1A | |
| SCHEMBL30873067 | 0.80 | RAB9A (0.68) | HDAC1HDAC2RAB9AADRA1DADRA1A | |
| SCHEMBL2010585 | 0.80 | RAB9A (0.68) | HDAC1HDAC2RAB9AADRA1DADRA1A | |
| SCHEMBL7291555 | 0.80 | RAB9A (0.72) | HDAC1HDAC2RAB9AADRA1DADRA1A | |
| SCHEMBL8667679 | 0.79 | DRD2 (0.48) | HDAC1HDAC2CA12CA9CA2 | |
| SCHEMBL8671281 | 0.79 | HDAC1 (0.49) | HDAC1HDAC2RAB9AADRA1DADRA1A | |
| SCHEMBL9400925 | 0.77 | HTR1A (0.70) | HDAC1HDAC2RAB9AADRA1DADRA1A | |
| SCHEMBL7299633 | 0.76 | RAB9A (1.00) | HDAC1HDAC2RAB9ACA12CA9 | |
| SCHEMBL8670390 | 0.76 | HDAC1 (0.53) | HDAC1HDAC2RAB9AADRA1DADRA1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5760054-A | BENIGN PROSTATIC HYPERTROPHY | MERCK & CO., INC. (US) | 1998-06-02 | — | — | US | disclosed |
| EP-0755392-A4 | ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1997-05-02 | — | — | EP | disclosed |
| EP-0755392-A1 | ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO. INC. (US) | 1997-01-29 | — | — | EP | disclosed |
| WO-1995028397-A1 | ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1995-10-26 | — | — | WO | disclosed |