Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.43 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.42 |
| ▸ | KLK1 | P06870 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7333071 | 0.85 | MEN1 (0.43) | ITGB3ITGA2BCASP1RAB9ASMN1; SMN2 | |
| SCHEMBL7365496 | 0.85 | ITGB3 (0.41) | ITGB3ITGA2BKDM4ECASP1RAB9A | |
| SCHEMBL9222050 | 0.84 | PTPN1 (0.54) | KDM4ERAB9ASMN1; SMN2ADAMTS5PTPN1 | |
| SCHEMBL7404441 | 0.83 | KLK7 (0.51) | CASP1HDAC8CA5A | |
| SCHEMBL9224285 | 0.81 | CASP1 (0.47) | ITGB3ITGA2BCASP1RAB9ASMN1; SMN2 | |
| SCHEMBL9220637 | 0.78 | CASP1 (0.55) | CASP1HDAC8CA5A | |
| SCHEMBL11709662 | 0.78 | CA5A (0.60) | CASP1SMN1; SMN2CA5A | |
| SCHEMBL9224769 | 0.77 | KLK7 (0.45) | ITGB3ITGA2BSMN1; SMN2CA5A | |
| SCHEMBL11714376 | 0.77 | CTSK (0.61) | RAB9ASMN1; SMN2HDAC8CA5A | |
| SCHEMBL11707023 | 0.76 | CA5A (0.58) | CASP1SMN1; SMN2CA5A |
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-5430024-A | Peptides bearing N-terminal amidino moieties and their use as inhibitors of platelet aggregation | HOFFMANN-LA ROCHE INC. (US) | 1995-07-04 | — | — | US | disclosed |
| US-5273982-A | An amidinoaryleneamidoalkylpiperazinyleneacetic acid | HOFFMANN-LA ROCHE INC. (US) | 1993-12-28 | — | — | US | disclosed |