Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 3/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | GSTK1 | Q9Y2Q3 | 1/20 | 0.37 |
| ▸ | QRFPR | Q96P65 | 1/20 | 0.36 |
| ▸ | NPY4R | P50391 | 6/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 6/20 | 0.36 |
| ▸ | NPY1R | P25929 | 5/20 | 0.36 |
| ▸ | NPY2R | P49146 | 3/20 | 0.36 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.35 |
| ▸ | MDM4 | O15151 | 1/20 | 0.34 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.34 |
| ▸ | ITGAV | P06756 | 1/20 | 0.34 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.34 |
| ▸ | TFPI | P10646 | 1/20 | 0.34 |
| ▸ | IL23R | Q5VWK5 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19426417 | 1.00 | ITGB3 (0.40) | ITGB3ITGA2BPTGS1GSTK1QRFPR | |
| SCHEMBL21961850 | 1.00 | ITGB3 (0.40) | ITGB3ITGA2BPTGS1GSTK1QRFPR | |
| SCHEMBL29630767 | 0.95 | NPY4R (0.39) | ITGB3ITGA2BPTGS1GSTK1QRFPR | |
| SCHEMBL12015094 | 0.93 | QRFPR (0.40) | ITGB3ITGA2BQRFPRNPY4RNPY5R | |
| SCHEMBL12646501 | 0.93 | ITGB3 (0.38) | ITGB3ITGA2BPTGS1GSTK1QRFPR | |
| SCHEMBL29405094 | 0.93 | ITGB3 (0.38) | ITGB3ITGA2BPTGS1GSTK1QRFPR | |
| SCHEMBL29591850 | 0.93 | QRFPR (0.39) | ITGB3ITGA2BPTGS1GSTK1QRFPR | |
| SCHEMBL29354257 | 0.93 | PTGS1 (0.41) | PTGS1GSTK1QRFPRNPY4RNPY5R | |
| SCHEMBL29590376 | 0.92 | QRFPR (0.42) | PTGS1GSTK1QRFPRNPY4RNPY5R | |
| SCHEMBL29630453 | 0.92 | PTGS1 (0.39) | PTGS1GSTK1QRFPRNPY4RNPY5R |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017172930-A1 | PBD CONJUGATES FOR TREATING DISEASES | ENDOCYTE, INC. (US) | 2017-10-05 | — | — | WO | disclosed |