Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL809451 | 1.00 | CA1 (0.53) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL27165039 | 1.00 | CA1 (0.53) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL27204437 | 1.00 | CA1 (0.53) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL27204438 | 1.00 | CA1 (0.53) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL813507 | 1.00 | CA1 (0.53) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL30735725 | 0.96 | CA1 (0.48) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL10491745 | 0.86 | CA1 (0.43) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL10491666 | 0.86 | MAPT (0.49) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL10491694 | 0.86 | MAPT (0.49) | CA1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL13254555 | 0.86 | ALDH1A1 (0.46) | CA1ALDH1A1KDM4EHPGDNPC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116284761-A | Preparation and application of chiral cyclohexanediamine supported polyisonitrile catalyst | 北方民族大学 | 2023-06-23 | — | — | CN | disclosed |
| EP-0821674-B1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | SEARLE & CO (US) | 2003-08-06 | — | — | EP | disclosed |
| US-6011028-A | Cyclic amidino agents useful as nitric oxide synthase inhibitors | G.D. SEARLE & CO. (US) | 2000-01-04 | — | — | US | disclosed |
| EP-0821674-A1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996033175-A1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 1996-10-24 | — | — | WO | disclosed |