Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE2 | O96020 | 1/20 | 0.44 |
| ▸ | CDK4 | P11802 | 1/20 | 0.44 |
| ▸ | CCND1 | P24385 | 1/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 13/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7833601 | 0.78 | NPC1 (0.39) | CCNE2CDK4CCND1CCNE1CDK2 | |
| SCHEMBL9458576 | 0.74 | ESR1 (0.51) | CCNE2CDK4CCND1CCNE1CDK2 | |
| SCHEMBL9458592 | 0.74 | DHODH (0.43) | POLBALDH1A1 | |
| SCHEMBL9458485 | 0.72 | KDM4E (0.50) | NPC1POLBALDH1A1 | |
| SCHEMBL9458599 | 0.72 | ALDH1A1 (0.37) | MCHR1NPC1POLBALDH1A1 | |
| SCHEMBL9458614 | 0.72 | TYMS (0.39) | CDK2MCHR1NPC1POLBALDH1A1 | |
| SCHEMBL9273904 | 0.72 | KDM4E (0.47) | NPC1POLBALDH1A1 | |
| SCHEMBL9458374 | 0.69 | MAPT (0.43) | POLBALDH1A1OPRL1 | |
| SCHEMBL9458139 | 0.67 | APP (0.43) | ALDH1A1 | |
| SCHEMBL9680806 | 0.66 | ALDH1A1 (0.40) | MCHR1NPC1ALDH1A1 |
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-5245035-A | HETEROCYCLIC BORON COMPOUNDS AS INTERMEDIATES FOR ANGIOTENSIN II ANTAGONISTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-09-14 | — | — | US | claimed |
| EP-0495627-A1 | Boron compounds | ZENECA LIMITED (GB) | 1992-07-22 | — | — | EP | claimed |
| US-5245035-A | HETEROCYCLIC BORON COMPOUNDS AS INTERMEDIATES FOR ANGIOTENSIN II ANTAGONISTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-09-14 | — | — | US | disclosed |
| EP-0495627-A1 | Boron compounds | ZENECA LIMITED (GB) | 1992-07-22 | — | — | EP | disclosed |