Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6776257 | 0.85 | TRPV1 (0.53) | LMNAMAPTKMT2AALDH1A1MEN1 | |
| SCHEMBL6782416 | 0.81 | PPID (0.47) | LMNAMAPTALDH1A1KDM4ECYP3A4 | |
| SCHEMBL20502747 | 0.80 | ALDH1A1 (0.68) | KMT2AALDH1A1PKM | |
| SCHEMBL13991528 | 0.79 | CYP4F2 (0.64) | KCNJ1KCNH2LMNAMAPTKMT2A | |
| SCHEMBL6781100 | 0.79 | ALDH1A1 (0.45) | LMNAMAPTALDH1A1KDM4E | |
| SCHEMBL6774976 | 0.79 | POLB (0.47) | LMNAMAPTALDH1A1GAACYP2C19 | |
| SCHEMBL27541550 | 0.79 | NAMPT (0.57) | LMNAMAPTKMT2AALDH1A1MEN1 | |
| SCHEMBL7056969 | 0.78 | KCNJ1 (0.54) | KCNJ1KCNH2LMNAMAPTKMT2A | |
| SCHEMBL7619439 | 0.78 | ALDH1A1 (0.44) | MAPTKMT2AALDH1A1MEN1KDM4E | |
| SCHEMBL9386013 | 0.77 | KMT2A (0.54) | LMNAMAPTKMT2AALDH1A1MEN1 |
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-4073929-A | HYPOTENSIVE AGENTS | MERCK & CO., INC. (US) | 1978-02-14 | — | — | US | disclosed |
| US-4069333-A | 2-HYDRAZINO-3-PHENYLPROPIONIC ACID DECARBOXYLASE INHIBITORS, BENZOXAZOLE ANALINES | MERCK & CO., INC. (US) | 1978-01-17 | — | — | US | disclosed |
| US-4051251-A | DECARBOXYLASE INHIBITOR, BENZIMIDAZOLE AND BENZOXAZOLE ALANINES N | MERCK & CO., INC. (US) | 1977-09-27 | — | — | US | disclosed |