Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.53 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.53 |
| ▸ | STS | P08842 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | JAK1 | P23458 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.46 |
| ▸ | CCKBR | P32239 | 1/20 | 0.45 |
| ▸ | YAP1 | P46937 | 1/20 | 0.45 |
| ▸ | TACR1 | P25103 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7304645 | 0.94 | ITGB3 (0.60) | HTTITGB3ITGA2BSTSNPC1 | |
| SCHEMBL2263069 | 0.89 | ITGB3 (0.58) | HTTITGB3ITGA2BSTSSMN1; SMN2 | |
| SCHEMBL2263064 | 0.89 | ITGB3 (0.58) | HTTITGB3ITGA2BSTSSMN1; SMN2 | |
| SCHEMBL2263067 | 0.89 | ITGB3 (0.58) | HTTITGB3ITGA2BSTSSMN1; SMN2 | |
| SCHEMBL7500520 | 0.88 | ITGB3 (0.55) | HTTITGB3ITGA2BSTSSMN1; SMN2 | |
| SCHEMBL22622438 | 0.86 | ALDH1A1 (0.59) | STSSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL1938768 | 0.84 | HTT (0.64) | HTTITGB3ITGA2BSTSSMN1; SMN2 | |
| SCHEMBL19063927 | 0.83 | ITGB3 (0.59) | HTTITGB3ITGA2BSTSSMN1; SMN2 | |
| SCHEMBL30879864 | 0.83 | NPSR1 (0.64) | STSGPR119KDM4EPKMMAPK8 | |
| SCHEMBL27309928 | 0.83 | NPSR1 (0.64) | STSGPR119KDM4EPKMMAPK8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0445796-B1 | Derivatives of acetic acid containing peptide bonds | HOFFMANN LA ROCHE (CH) | 1998-06-17 | — | — | EP | disclosed |
| 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 |
| EP-0445796-A2 | Derivatives of acetic acid | F. HOFFMANN-LA ROCHE AG (CH) | 1991-09-11 | — | — | EP | disclosed |