Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.44 |
| ▸ | DRD3 | P35462 | 5/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.39 |
| ▸ | DRD2 | P14416 | 4/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.37 |
| ▸ | DPP4 | P27487 | 4/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7474275 | 0.92 | ITGB3 (0.51) | S1PR1ITGB3ITGA2BDRD3KCNH2 | |
| SCHEMBL7467606 | 0.91 | S1PR1 (0.43) | S1PR1ITGB3ITGA2BDRD3KCNH2 | |
| SCHEMBL7472620 | 0.90 | ITGB3 (0.49) | S1PR1ITGB3ITGA2BHDAC1 | |
| Hydrochloric Acid SCHEMBL7420584 | 0.88 | S1PR1 (0.54) | S1PR1DRD3KCNH2DRD2HDAC1 | |
| SCHEMBL7479149 | 0.87 | ITGB3 (0.40) | S1PR1ITGB3ITGA2BDRD3KCNH2 | |
| SCHEMBL7481405 | 0.87 | NR1H2 (0.42) | S1PR1ITGB3ITGA2BMEN1POLB | |
| SCHEMBL7483682 | 0.82 | DRD3 (0.40) | S1PR1DRD3KCNH2DRD2HDAC1 | |
| Hydrochloric Acid SCHEMBL7472463 | 0.80 | DRD3 (0.42) | S1PR1DRD3KCNH2DRD2HDAC1 | |
| Hydrochloric Acid SCHEMBL8557146 | 0.80 | S1PR1 (0.53) | S1PR1DRD3KCNH2DRD2HDAC1 | |
| SCHEMBL7481505 | 0.79 | DRD3 (0.41) | S1PR1DRD3KCNH2DRD2HDAC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0777667-A1 | CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT | Dr. Karl Thomae GmbH (DE) | 1997-06-11 | — | — | EP | disclosed |
| WO-1996005194-A1 | CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT | DR. KARL THOMAE GMBH (DE) | 1996-02-22 | — | — | WO | disclosed |