Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.54 |
| ▸ | NOS1 | P29475 | 1/20 | 0.54 |
| ▸ | NOS2 | P35228 | 1/20 | 0.54 |
| ▸ | CD44 | P16070 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5208334 | 0.86 | NOS3 (0.44) | NOS3NOS1NOS2PDK2CYP2A6 | |
| SCHEMBL12320089 | 0.85 | NOS3 (0.54) | NOS3NOS1NOS2PDK2CYP2A6 | |
| SCHEMBL4436882 | 0.80 | NOS3 (0.50) | NOS3NOS1NOS2CD44CYP2A6 | |
| SCHEMBL29535498 | 0.79 | HSP90AA1 (0.45) | NOS3NOS1NOS2CYP3A4TDP1 | |
| SCHEMBL1083427 | 0.79 | HSP90AA1 (0.45) | NOS3NOS1NOS2CYP3A4TDP1 | |
| SCHEMBL2936584 | 0.78 | NOS3 (0.44) | NOS3NOS1NOS2CD44PDK2 | |
| SCHEMBL23175282 | 0.77 | ALDH1A1 (0.48) | TDP1LMNAPLAUKMT2AMAPT | |
| SCHEMBL29625828 | 0.77 | ALDH1A1 (0.48) | TDP1LMNAPLAUKMT2AMAPT | |
| SCHEMBL19463671 | 0.77 | CD44 (0.50) | NOS3NOS1NOS2CD44PDK2 | |
| SCHEMBL21681654 | 0.77 | NOS3 (0.43) | NOS3NOS1NOS2CD44PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0563001-B1 | Imidazole compounds, their preparation and use | NEUROSEARCH AS (DK) | 1996-02-28 | — | — | EP | disclosed |
| US-5360809-A | Imidazole compounds and their use as calcium channel blockers | NEUROSEARCH A/S (DK) | 1994-11-01 | — | — | US | disclosed |
| EP-0563001-A1 | Imidazole compounds, their preparation and use | NEUROSEARCH A/S (DK) | 1993-09-29 | — | — | EP | disclosed |