Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 14/20 | 0.53 |
| ▸ | GRK2 | P25098 | 12/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | DDX3X | O00571 | 1/20 | 0.46 |
| ▸ | GRK3 | P35626 | 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 | |
|---|---|---|---|---|
| SCHEMBL1899895 | 0.85 | NR1H2 (0.58) | ROCK2GRK2PDE10ANPC1RAB9A | |
| SCHEMBL7658956 | 0.83 | DDX3X (0.50) | ROCK2NPC1RAB9ASMN1; SMN2DDX3X | |
| SCHEMBL26108539 | 0.81 | ADORA2A (0.47) | NPC1RAB9ADDX3X | |
| SCHEMBL7910285 | 0.80 | ROCK2 (0.56) | ROCK2GRK2PDE10A | |
| SCHEMBL7213157 | 0.79 | RARB (0.55) | NPC1ALDH1A1MAPTNFKB1RAB9A | |
| Hydrochloric Acid SCHEMBL14736164 | 0.79 | ROCK2 (0.55) | ROCK2GRK2PDE10A | |
| SCHEMBL29109555 | 0.77 | DDX3X (0.40) | GSK3BNPC1MAPTNFKB1RAB9A | |
| SCHEMBL4789632 | 0.76 | ROCK2 (0.56) | ROCK2GRK2PDE10A | |
| SCHEMBL7218544 | 0.76 | DDX3X (0.53) | NPC1ALDH1A1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL14289634 | 0.75 | ROCK2 (0.64) | ROCK2GRK2GRK3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6358984-B1 | FOR THERAPY OF HYPERTENSION AND/OR DISEASES SUCH AS HEART AND RENAL DISEASES | LEAD CHEMICAL CO., LTD. (JP) | 2002-03-19 | — | — | US | disclosed |
| US-6232335-B1 | A BIPHENYL TRIAZOLE COMPOUND USEFUL AS A ANGIOTENSIN II CONVERTING ENZYME INHIBITORS EFFECTIVE IN THE TREATMENT OF HYPERTENSION OR HEART FAILURE | LEAD CHEMICAL CO., LTD. (JP) | 2001-05-15 | — | — | US | disclosed |