Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 6/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 12/20 | 0.57 |
| ▸ | ADRA1D | P25100 | 11/20 | 0.55 |
| ▸ | ADRA1B | P35368 | 10/20 | 0.55 |
| ▸ | HRH1 | P35367 | 2/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6961341 | 0.90 | DRD2 (0.74) | DRD2ADRA1AADRA1DADRA1BHRH1 | |
| SCHEMBL7670825 | 0.90 | DRD2 (0.59) | DRD2ADRA1AADRA1DADRA1BHRH1 | |
| SCHEMBL7966084 | 0.90 | ADRA1D (0.66) | DRD2ADRA1AADRA1DADRA1B | |
| SCHEMBL7531578 | 0.87 | ADRA1A (0.59) | DRD2ADRA1AADRA1DADRA1BHRH1 | |
| SCHEMBL7661469 | 0.85 | ADRA1A (0.59) | DRD2ADRA1AADRA1DADRA1BHRH1 | |
| SCHEMBL7956108 | 0.81 | ADRA1D (0.68) | DRD2ADRA1AADRA1DADRA1B | |
| SCHEMBL7965434 | 0.80 | ADRA1D (0.66) | DRD2ADRA1AADRA1DADRA1B | |
| SCHEMBL7702063 | 0.80 | ADRA1A (0.55) | DRD2ADRA1AADRA1DADRA1B | |
| SCHEMBL6958964 | 0.79 | DRD2 (0.61) | DRD2ADRA1AADRA1DADRA1BHRH1 | |
| SCHEMBL3925930 | 0.77 | RORC (0.48) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6339090-B1 | FOR THERAPY OF BENIGN PROSTATIC HYPERPLASIA | MERCK & CO., INC. | 2002-01-15 | — | — | US | disclosed |
| US-6235759-B1 | BENIGN PROSTATIC HYPERPLASIA; HYPOTENSIVE AGENTS | MERCK & CO., INC. | 2001-05-22 | — | — | US | disclosed |
| WO-2000025782-A1 | DIHYDROPYRIDINONES AND PYRROLINONES USEFUL AS ALPHA 1A ADRENOCEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2000-05-11 | — | — | WO | disclosed |