Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.45 |
| ▸ | PTGER3 | P43115 | 3/20 | 0.45 |
| ▸ | PTGER2 | P43116 | 3/20 | 0.45 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 7/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.39 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | IAPP | P10997 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17208797 | 0.77 | CA1 (0.41) | THRB | |
| SCHEMBL30873948 | 0.76 | NPSR1 (0.57) | NPSR1PTGER4PTGER3PTGER2PTGER1 | |
| SCHEMBL1450886 | 0.76 | NPSR1 (0.57) | NPSR1PTGER4PTGER3PTGER2PTGER1 | |
| SCHEMBL29843936 | 0.76 | NPSR1 (0.61) | NPSR1PTGER4PTGER3PTGER2PTGER1 | |
| SCHEMBL323867 | 0.76 | NPSR1 (0.61) | NPSR1PTGER4PTGER3PTGER2PTGER1 | |
| SCHEMBL3110101 | 0.76 | CA12 (0.51) | NPSR1PTGER4PTGER3PTGER2PTGER1 | |
| SCHEMBL6580321 | 0.75 | NPSR1 (0.55) | NPSR1PTGER4PTGER3PTGER2PTGER1 | |
| Water SCHEMBL10936872 | 0.74 | NPSR1 (0.59) | NPSR1PTGER4PTGER3PTGER2PTGER1 | |
| Hydrochloric Acid SCHEMBL16238973 | 0.74 | NPSR1 (0.59) | NPSR1PTGER4PTGER3PTGER2PTGER1 | |
| SCHEMBL9643686 | 0.73 | NPSR1 (0.53) | NPSR1PTGER4PTGER3PTGER2PTGER1 |
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-5859239-A | Mercaptoalkanoylamino and acylmercaptoalkanoylamino benzoxazepines and benzothiazepines | E. R. SQUIBB & SONS, INC. (US) | 1999-01-12 | — | — | US | disclosed |
| US-5856476-A | Processes for preparing azepiones useful as intermediates in the preparation of inhibitors of angiotensin converting enzyme and neutral endopeptidase | E. R. SQUIBBS & SONS, INC. (US) | 1999-01-05 | — | — | US | disclosed |
| US-5856477-A | HYPOTENSIVE AGENTS; CONGESTIVE HEART FAILURE | E. R. SQUIBB & SONS, INC. (US) | 1999-01-05 | — | — | US | disclosed |