Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 17/20 | 0.57 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7790361 | 0.84 | TACR1 (0.61) | TACR1 | |
| SCHEMBL7658708 | 0.82 | TACR1 (0.58) | TACR1TBXAS1 | |
| SCHEMBL7796987 | 0.81 | TBXAS1 (0.71) | TACR1TBXAS1CYP11B1CYP11B2 | |
| SCHEMBL7797108 | 0.80 | TACR1 (0.57) | TACR1 | |
| SCHEMBL7797103 | 0.80 | MAPT (0.54) | TACR1 | |
| SCHEMBL7797113 | 0.79 | TBXAS1 (0.52) | TACR1TBXAS1 | |
| SCHEMBL7797019 | 0.78 | TACR1 (0.55) | TACR1TBXAS1 | |
| SCHEMBL7571685 | 0.78 | TACR1 (0.57) | TACR1CYP11B1CYP11B2 | |
| SCHEMBL7797005 | 0.78 | TACR1 (0.59) | TACR1 | |
| SCHEMBL7655822 | 0.78 | TACR1 (0.56) | TACR1CYP11B1CYP11B2 |
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-6476045-B2 | INDOLE AND AZAINDOLE DERIVATIVES AND THEIR USE AS TACHYKININ ANTAGONISTS, AND IN PARTICULAR AS NEUROKININ-1 RECEPTOR ANTAGONIST | MERCK SHARP & DOHME LTD. (GB) | 2002-11-05 | — | — | US | disclosed |