Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 6/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ADK | P55263 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 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 | |
|---|---|---|---|---|
| SCHEMBL11148029 | 0.83 | ALDH1A1 (0.48) | KDM4EPOLBKMT2AALDH1A1MAPK1 | |
| SCHEMBL11218532 | 0.81 | PIK3CA (0.47) | KDM4ECYP1A2CYP2D6MAPTPOLB | |
| SCHEMBL14725974 | 0.81 | ALDH1A1 (0.48) | KDM4ECYP1A2CYP2D6MAPTPOLB | |
| SCHEMBL11224235 | 0.79 | KDM4E (0.51) | KDM4ECYP1A2CYP2D6MAPTPOLB | |
| SCHEMBL10871103 | 0.75 | ADK (0.47) | KDM4ECYP1A2CYP2D6MAPTCNR2 | |
| SCHEMBL11229317 | 0.75 | NOS1 (0.58) | KDM4EMAPTPOLBALDH1A1MAPK1 | |
| SCHEMBL21855232 | 0.74 | PIK3CD (0.46) | KDM4ECYP1A2CYP2D6MAPTCNR2 | |
| SCHEMBL11142308 | 0.74 | KDM4E (0.46) | KDM4ECYP1A2POLBALDH1A1MAPK1 | |
| SCHEMBL23980717 | 0.73 | CNR2 (0.54) | KDM4ECYP1A2CYP2D6MAPTCNR2 | |
| SCHEMBL11218413 | 0.72 | POLB (0.50) | KDM4ECYP1A2MAPTPOLBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4343802-A | ADRENERGIC BLOCKING, ANTIARRYHYTHMIA, AND CARDIOTONIC AGENTS | MERCK, SHARP & DOHME (I.A.) CORP. (US) | 1982-08-10 | — | — | US | disclosed |
| US-4193995-A | B-ADRENERGIC BLOCKING AGENTS | MERCK SHARP & DOHME (I.A.) CORP. (US) | 1980-03-18 | — | — | US | disclosed |
| US-4042586-A | ADRENERGIC BLOCKING AGENTS | MERCK SHARP & DOHME (I.A.) CORPORATION (US) | 1977-08-16 | — | — | US | disclosed |
| US-3946009-A | ADRENERGIC BLOCKING AGENTS | MERCK SHARP & DOHME (I.A.) CORPORATION (US) | 1976-03-23 | — | — | US | disclosed |