Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 3/20 | 0.47 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7352508 | 0.83 | ITGB3 (0.42) | ITGB3ITGA2BALDH1A1NPSR1LMNA | |
| SCHEMBL7344701 | 0.82 | MAPT (0.44) | ALDH1A1NPSR1MAPTPOLBRAB9A | |
| SCHEMBL7534287 | 0.82 | ITGB3 (0.70) | ITGB3ITGA2BALDH1A1LMNAMAPT | |
| SCHEMBL5163341 | 0.82 | ITGB3 (0.70) | ITGB3ITGA2BALDH1A1LMNAMAPT | |
| SCHEMBL3046616 | 0.81 | ITGB3 (0.67) | ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7076619 | 0.80 | ITGB3 (0.66) | ITGB3ITGA2B | |
| SCHEMBL6981700 | 0.80 | ALDH1A1 (0.42) | ITGB3ITGA2BALDH1A1NPSR1LMNA | |
| SCHEMBL6981928 | 0.80 | RAB9A (0.45) | ALDH1A1NPSR1LMNAMAPTGAA | |
| SCHEMBL7348958 | 0.80 | ITGB3 (0.51) | ITGB3ITGA2BALDH1A1LMNAMAPT | |
| SCHEMBL7346612 | 0.79 | ITGB3 (0.50) | ITGB3ITGA2BALDH1A1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5536869-A | Process for the preparation of ethyl 3S-[4-[[4-(aminoiminomethyl)phenyl]amino]-1,4-dioxobutyl]amino]-4-pentynoate | G. D. SEARLE & CO. (US) | 1996-07-16 | — | — | US | disclosed |