Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 4/20 | 0.50 |
| ▸ | NOTUM | Q6P988 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL311297 | 0.85 | KCNJ1 (0.54) | KCNJ1NOTUMALDH1A1HTTLMNA | |
| SCHEMBL8466868 | 0.82 | KCNJ1 (0.50) | KCNJ1NOTUMALDH1A1HTTLMNA | |
| SCHEMBL8530663 | 0.82 | HPGD (0.54) | KCNJ1ALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL6580030 | 0.80 | KCNJ1 (0.48) | KCNJ1NOTUMALDH1A1HTTLMNA | |
| SCHEMBL6580036 | 0.76 | KCNJ1 (0.47) | KCNJ1NOTUMALDH1A1HTTLMNA | |
| SCHEMBL6581553 | 0.75 | KCNJ1 (0.46) | KCNJ1NOTUMALDH1A1HTTLMNA | |
| SCHEMBL310636 | 0.75 | KCNJ1 (0.58) | KCNJ1NOTUMALDH1A1LMNAMAPT | |
| SCHEMBL8531830 | 0.74 | KCNJ1 (0.54) | KCNJ1NOTUMALDH1A1HTTLMNA | |
| SCHEMBL4212154 | 0.72 | MAPT (0.57) | KCNJ1NOTUMALDH1A1HTTLMNA | |
| SCHEMBL4203264 | 0.72 | NOTUM (0.55) | NOTUMLMNATP53MEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0858444-A4 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1999-12-01 | — | — | EP | disclosed |
| EP-0858444-A1 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1998-08-19 | — | — | EP | disclosed |
| US-5750549-A | ANTIINFLAMMATORY AGENTS OR ANALGESICS | MERCK & CO., INC. (US) | 1998-05-12 | — | — | US | disclosed |
| WO-1997014671-A1 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1997-04-24 | — | — | WO | disclosed |