Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 7/20 | 0.39 |
| ▸ | BCHE | P06276 | 4/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | UHRF1 | Q96T88 | 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 | |
|---|---|---|---|---|
| SCHEMBL9218440 | 0.96 | NOS3 (0.48) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL20416983 | 0.81 | NOS3 (0.59) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL527227 | 0.77 | NOS3 (0.64) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL29621658 | 0.77 | NOS3 (0.64) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL9458347 | 0.76 | NOS3 (0.44) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL21963078 | 0.76 | NOS3 (0.53) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL31475655 | 0.76 | NOS3 (0.53) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL9458497 | 0.76 | POLB (0.40) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL20417066 | 0.75 | NOS3 (0.62) | NOS3NOS1NOS2KDM4ENPC1 | |
| SCHEMBL10268953 | 0.74 | EHMT2 (0.43) | NOS3NOS1NOS2KDM4ENPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5245035-A | HETEROCYCLIC BORON COMPOUNDS AS INTERMEDIATES FOR ANGIOTENSIN II ANTAGONISTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-09-14 | — | — | US | claimed |
| US-5245035-A | HETEROCYCLIC BORON COMPOUNDS AS INTERMEDIATES FOR ANGIOTENSIN II ANTAGONISTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-09-14 | — | — | US | disclosed |