Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK1 | P06870 | 2/20 | 0.51 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.51 |
| ▸ | F2 | P00734 | 4/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.48 |
| ▸ | PLG | P00747 | 1/20 | 0.48 |
| ▸ | PLAU | P00749 | 1/20 | 0.48 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.48 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.47 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.47 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.47 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1999045 | 0.88 | F2 (0.59) | F2PRSS1PLGPLAUKLKB1 | |
| Hydrochloric Acid SCHEMBL11226180 | 0.86 | F2 (0.57) | F2PRSS1PLGPLAUKLKB1 | |
| Phenylguanidine SCHEMBL7425328 | 0.84 | CHIT1 (0.49) | KLK1KLK5F2PRSS1PLG | |
| Terephthalamide SCHEMBL30182529 | 0.82 | PARP1 (0.56) | ALDH1A1L3MBTL1KMT2AMAPTPOLB | |
| Trifluoroacetic Acid SCHEMBL7417053 | 0.81 | ITGB3 (0.53) | KLK1KLK5F2PRSS1PLG | |
| Trifluoroacetic Acid SCHEMBL6932230 | 0.81 | MLYCD (0.48) | KLK1KLK5F2ALDH1A1L3MBTL1 | |
| 4-Guanidino-Benzoic Acid SCHEMBL9303333 | 0.80 | F2 (0.61) | F2PRSS1PLGPLAUKLKB1 | |
| SCHEMBL25845706 | 0.79 | CA12 (0.59) | F2PRSS1PLGPLAUKLKB1 | |
| 4-Guanidino-Benzoic Acid SCHEMBL211005 | 0.78 | F2 (0.57) | F2PRSS1TMPRSS6PRSS2PRSS3 | |
| Nitric Acid SCHEMBL4070418 | 0.78 | TSHR (0.50) | F2PRSS1PLGPLAUKLKB1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117447375-A | Guanidine compound, preparation method and application thereof | 中国医学科学院药物研究所 | 2024-01-26 | — | — | CN | disclosed |