Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PRCP | P42785 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.40 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18873529 | 0.94 | ITGB1 (0.42) | ITGB1ITGA4DPP4DPP8DPP9 | |
| SCHEMBL18831922 | 0.89 | HSD17B10 (0.44) | KDM1ARCOR1KDM4ELMNACTSL | |
| SCHEMBL18831932 | 0.87 | KDM1A (0.51) | KDM1ARCOR1KDM4ELMNACTSL | |
| SCHEMBL18831935 | 0.87 | KDM1A (0.51) | KDM1ARCOR1KDM4ELMNACTSL | |
| SCHEMBL18831944 | 0.83 | FAP (0.42) | ITGB1ITGA4DPP4DPP8DPP9 | |
| SCHEMBL18873440 | 0.82 | PREP (0.45) | KDM1ARCOR1ITGB1ITGA4DPP4 | |
| Hydrochloric Acid SCHEMBL18831929 | 0.82 | PREP (0.44) | KDM1ARCOR1ITGB1ITGA4DPP4 | |
| Hydrochloric Acid SCHEMBL18831927 | 0.82 | PREP (0.44) | KDM1ARCOR1ITGB1ITGA4DPP4 | |
| SCHEMBL18873807 | 0.80 | SIRT5 (0.50) | CTSKSIRT5 | |
| SCHEMBL11063150 | 0.80 | CTRB1 (0.57) | KDM1ARCOR1KDM4ELMNACTSL |
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-9650414-B1 | Dual-action EP4 agonist—bisphosphonate conjugates and uses thereof | SIMON FRASER UNIVERSITY (CA) | 2017-05-16 | — | — | US | disclosed |