Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 6/20 | 0.51 |
| ▸ | CA12 | O43570 | 5/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.51 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8667641 | 0.85 | ADRA1D (0.39) | CA9CA12ADRA1DADRA1AADRA1B | |
| SCHEMBL8667503 | 0.83 | ADRA1D (0.51) | CA9CA12ADRA1DADRA1AADRA1B | |
| SCHEMBL7815416 | 0.83 | ADRA1D (0.51) | CA9CA12ADRA1DADRA1AADRA1B | |
| SCHEMBL8670252 | 0.83 | ADRA1D (0.53) | CA9CA12ADRA1DADRA1AADRA1B | |
| SCHEMBL8047906 | 0.81 | CA9 (0.49) | CA9CA12ADRA1DADRA1AADRA1B | |
| SCHEMBL6324557 | 0.80 | CA9 (0.73) | CA9CA12ADRA1DADRA1AADRA1B | |
| SCHEMBL8671286 | 0.79 | HDAC1 (0.55) | CA9CA12ADRA1DADRA1AADRA1B | |
| SCHEMBL9400876 | 0.79 | ADRA1D (0.49) | CA9CA12ADRA1DADRA1AADRA1B | |
| SCHEMBL4033933 | 0.78 | CA9 (0.71) | CA9CA12CA2ACHEHDAC1 | |
| SCHEMBL5354797 | 0.78 | CA9 (0.71) | CA9CA12CA2ACHEHDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5760054-A | BENIGN PROSTATIC HYPERTROPHY | MERCK & CO., INC. (US) | 1998-06-02 | — | — | US | disclosed |