Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 2/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 7/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.46 |
| ▸ | CTSL | P07711 | 2/20 | 0.44 |
| ▸ | CTSK | P43235 | 2/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8615937 | 0.99 | CTRB1 (0.49) | CTRB1ITGB3ITGA2BPPARGCTSL | |
| SCHEMBL8611915 | 0.86 | ITGB3 (0.56) | CTRB1ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL8612059 | 0.85 | ITGB3 (0.55) | CTRB1ITGB3ITGA2B | |
| SCHEMBL1823130 | 0.83 | CTRB1 (0.55) | CTRB1ITGB3ITGA2BPPARGCTSL | |
| SCHEMBL1823016 | 0.82 | CTRB1 (0.54) | CTRB1ITGB3ITGA2BPPARGCTSL | |
| SCHEMBL1824729 | 0.80 | CTRB1 (0.52) | CTRB1ITGB3ITGA2BPPARGSYK | |
| SCHEMBL1825873 | 0.79 | CTRB1 (0.51) | CTRB1ITGB3ITGA2BPPARGCTSL | |
| SCHEMBL5158241 | 0.79 | CTRB1 (0.53) | CTRB1ITGB3ITGA2BCTSLCTSK | |
| SCHEMBL1824337 | 0.78 | SYK (0.53) | CTRB1ITGB3ITGA2BPPARGCTSL | |
| SCHEMBL1825917 | 0.78 | ALDH1A1 (0.58) | ITGB3ITGA2BPPARGCTSLCTSK |
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-0680467-B1 | PROCESS FOR PREPARING C-SUBSTITUTED DIETHYLENE TRIAMINES | SCHERING AG (DE) | 1998-04-22 | — | — | EP | disclosed |
| US-5654467-A | Process for the production of C-substituted diethylenetriamines | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-08-05 | — | — | US | disclosed |
| EP-0680467-A1 | PROCESS FOR PREPARING C-SUBSTITUTED DIETHYLENE TRIAMINES | SCHERING AKTIENGESELLSCHAFT (DE) | 1995-11-08 | — | — | EP | disclosed |
| WO-1994017033-A1 | PROCESS FOR PREPARING C-SUBSTITUTED DIETHYLENE TRIAMINES | SCHERING AKTIENGESELLSCHAFT (DE) | 1994-08-04 | — | — | WO | disclosed |