Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 10/20 | 0.53 |
| ▸ | ITGAV | P06756 | 5/20 | 0.53 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.53 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.53 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.52 |
| ▸ | ITGB5 | P18084 | 2/20 | 0.51 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.48 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.47 |
| ▸ | CTSG | P08311 | 1/20 | 0.46 |
| ▸ | MC4R | P32245 | 5/20 | 0.46 |
| ▸ | MC5R | P33032 | 5/20 | 0.46 |
| ▸ | MC3R | P41968 | 5/20 | 0.46 |
| ▸ | MC1R | Q01726 | 5/20 | 0.46 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | KDM4A | O75164 | 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 | |
|---|---|---|---|---|
| SCHEMBL24285405 | 1.00 | ITGB3 (0.53) | ITGB3ITGAVITGB1ITGA5ITGA2B | |
| SCHEMBL24285406 | 0.94 | ITGB3 (0.60) | ITGB3ITGAVITGB1ITGA5ITGA2B | |
| SCHEMBL19623138 | 0.92 | ITGB3 (0.54) | ITGB3ITGAVITGB1ITGA5ITGA2B | |
| SCHEMBL15308349 | 0.92 | ITGB3 (0.53) | ITGB3ITGAVITGB1ITGA5ITGA2B | |
| SCHEMBL10049936 | 0.91 | ITGB3 (0.56) | ITGB3ITGAVITGA2BITGB5CXCR4 | |
| SCHEMBL29393726 | 0.91 | ITGB3 (0.59) | ITGB3ITGAVITGA2BITGB5CXCR4 | |
| SCHEMBL21440742 | 0.91 | ITGB3 (0.52) | ITGB3ITGAVITGB1ITGA5ITGA2B | |
| SCHEMBL19498883 | 0.90 | ITGB3 (0.52) | ITGB3ITGAVITGB1ITGA5ITGA2B | |
| SCHEMBL16301538 | 0.90 | ITGB3 (0.55) | ITGB3ITGAVITGB1ITGA5ITGA2B | |
| SCHEMBL21440744 | 0.90 | ITGB3 (0.51) | ITGB3ITGAVITGB1ITGA5ITGA2B |
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-9463254-B2 | Molecular design toward dual-modality probes for radioisotope-based imaging (PET or SPECT) and MRI | THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2016-10-11 | — | — | US | disclosed |